SCHEMBL5311535

SCHEMBL5311535

Cc1cc(-c2ccc(S(C)(=O)=O)cc2)n(-c2ccc(F)cc2)c1Br

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.73
PTGS1 P23219 2/20 0.73

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
SCHEMBL5309879 0.86 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL5965074 0.86 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL5308946 0.84 PTGS2 (0.73) PTGS2PTGS1
SCHEMBL7210478 0.84 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL7212067 0.81 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL5311840 0.80 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL3823026 0.79 PTGS2 (0.75) PTGS2PTGS1
SCHEMBL7212040 0.79 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL5313386 0.79 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL3824218 0.79 PTGS2 (0.78) PTGS2PTGS1

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