SCHEMBL5314124

SCHEMBL5314124

Cc1cc(-c2ccc(S(N)(=O)=O)cc2)n(-c2ccc(Cl)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 8/20 0.66
PTGS2 P35354 7/20 0.56
PTGS1 P23219 5/20 0.56
CYP2D6 P10635 1/20 0.54
CA12 O43570 3/20 0.52
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA9 Q16790 3/20 0.52
PDPK1 O15530 1/20 0.52
CA3 P07451 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA5A P35218 1/20 0.51
CA7 P43166 1/20 0.51
CA13 Q8N1Q1 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51

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
SCHEMBL347440 1.00 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CYP2D6CA12
SCHEMBL5312529 0.90 PTGS2 (0.58) CHRNA7PTGS2PTGS1CYP2D6CA12
SCHEMBL347020 0.90 PTGS2 (0.58) CHRNA7PTGS2PTGS1CYP2D6CA12
SCHEMBL5314866 0.86 PTGS2 (0.55) CHRNA7PTGS2PTGS1CA12CA1
SCHEMBL2839074 0.86 CHRNA7 (0.53) CHRNA7PTGS2PTGS1CYP2D6CA12
SCHEMBL2464195 0.86 CHRNA7 (0.50) CHRNA7PTGS2PTGS1CYP2D6CA12
SCHEMBL5309196 0.86 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CA12CA1
SCHEMBL2466828 0.86 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CA12CA1
SCHEMBL2462524 0.85 PTGS2 (0.60) CHRNA7PTGS2PTGS1CA12CA1
SCHEMBL2465743 0.84 PTGS2 (0.55) CHRNA7PTGS2PTGS1CYP2D6CA12

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799823-B1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses DAIICHI SANKYO CO LTD (JP) 2007-10-31 EP disclosed
US-RE39420-E1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 2006-12-05 US disclosed
CN-1151126-C 1, 2-diphenylpyrrole derivatives, their preparation and their therapeutic uses ������������ʽ���� 2004-05-26 CN disclosed
US-5908858-A OSTEOPOROSIS; LEUKOTRIENE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1999-06-01 US disclosed
CN-1168372-A 1, 2-diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1997-12-24 CN disclosed
EP-0799823-A1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1997-10-08 EP disclosed