SCHEMBL5309196

SCHEMBL5309196

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

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 5/20 0.66
PTGS2 P35354 13/20 0.64
PTGS1 P23219 9/20 0.64
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA12 O43570 2/20 0.56
CA9 Q16790 2/20 0.56
CA5A P35218 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
SCHEMBL2466828 1.00 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL5312529 0.90 PTGS2 (0.58) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL347020 0.90 PTGS2 (0.58) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL5312684 0.87 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL5314070 0.87 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL5311179 0.86 PTGS2 (0.61) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL5314124 0.86 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL347440 0.86 CHRNA7 (0.66) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL2839074 0.86 CHRNA7 (0.53) CHRNA7PTGS2PTGS1CA1CA2
SCHEMBL2464195 0.86 CHRNA7 (0.50) CHRNA7PTGS2PTGS1CA1CA2

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