Computer-Aided Classification of New Psychoactive Substances

Table 4

Similarity measures for the molecule CID 9889172 and the molecules in Group 1.

CID	Query_Size	Target_Size	Tanimoto_Coefficient	Overlap_Coefficient
9889172	24	24	1.0000	1.0000
117587582	24	24	0.9200	0.9583
10226340	24	26	0.8519	0.9583
57507911	24	24	0.8469	0.9167
56841530	24	24	0.8469	0.9167
57507905	24	23	0.8077	0.9130
56463	24	28	0.5758	0.7917