SCHEMBL8475151

SCHEMBL8475151

Cc1cc(-c2ccccc2)cc(S(N)(=O)=O)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 17/20 0.57
CA9 Q16790 15/20 0.57
CA1 P00915 15/20 0.57
CA12 O43570 4/20 0.57
CA3 P07451 2/20 0.48
CA6 P23280 2/20 0.48
CA5A P35218 2/20 0.48
CA7 P43166 2/20 0.48
CA5B Q9Y2D0 2/20 0.48
CA13 Q8N1Q1 2/20 0.48
CA4 P22748 1/20 0.48
PLA2G7 Q13093 1/20 0.48
CA14 Q9ULX7 1/20 0.48
IKBKB O14920 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25762191 0.79 RXRA (0.38) CA2CA9CA1
SCHEMBL8481494 0.78 CA2 (0.57) CA2CA9CA1CA12CA3
SCHEMBL2005577 0.77 CA2 (0.56) CA2CA9CA1CA12CA3
SCHEMBL1926937 0.76 CA2 (0.67) CA2CA9CA1CA12CA3
SCHEMBL19474971 0.75 CA2 (0.49) CA2CA9CA1CA12CA3
SCHEMBL30406022 0.75 CA2 (0.49) CA2CA9CA1CA12CA3
SCHEMBL24444327 0.75 ALDH1A1 (0.53) MAOA
SCHEMBL1830671 0.75 RXRA (0.54) MAOA
SCHEMBL2837502 0.75 ALDH1A1 (0.53) MAOA
SCHEMBL6171121 0.74 CA2 (0.75) CA2CA9CA1CA12CA3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5859257-A ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed