SCHEMBL5333903

SCHEMBL5333903

Cc1ccn(-c2ccc(S(N)(=O)=O)cc2)c1-c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.60
PTGS1 P23219 7/20 0.60
CA1 P00915 8/20 0.52
CA2 P00918 8/20 0.52
CA9 Q16790 7/20 0.52
CA12 O43570 3/20 0.52
CHRNA7 P36544 3/20 0.49
CA4 P22748 4/20 0.48
CA5A P35218 1/20 0.47
CA5B Q9Y2D0 1/20 0.47

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
SCHEMBL2465658 0.89 PTGS2 (0.60) PTGS2PTGS1CA1CA2CA9
SCHEMBL5316308 0.87 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL5337610 0.84 PTGS2 (0.47) PTGS2PTGS1CA1CA2CA9
SCHEMBL27448843 0.84 CA2 (0.53) PTGS2PTGS1CA1CA2CA9
SCHEMBL3690374 0.84 PTGS2 (0.47) PTGS2PTGS1CA1CA2CA9
SCHEMBL5309164 0.84 CA1 (0.55) PTGS2PTGS1CA1CA2CA9
SCHEMBL2466828 0.76 CHRNA7 (0.66) PTGS2PTGS1CA1CA2CA9
SCHEMBL5309196 0.76 CHRNA7 (0.66) PTGS2PTGS1CA1CA2CA9
SCHEMBL5312580 0.75 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL2463751 0.74 PTGS2 (1.00) PTGS2PTGS1CA1CA2CA9

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 4 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
US-5908858-A OSTEOPOROSIS; LEUKOTRIENE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1999-06-01 US disclosed
EP-0799823-A1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1997-10-08 EP disclosed