SCHEMBL8925320

SCHEMBL8925320

CS(=O)(=O)c1ccc(-c2[nH]nc(C(F)(F)F)c2-c2ccc(CO)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.47
PTGS1 P23219 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38

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
SCHEMBL8640384 0.91 PTGS2 (0.45) PTGS2PTGS1PTGDR2
SCHEMBL8766048 0.85 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL5078441 0.85 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL6180483 0.85 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL4212020 0.84 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL8926255 0.81 PSD (0.47) PTGS2
SCHEMBL8925536 0.80 PTGS2 (0.44) PTGS2PTGDR2
SCHEMBL8925255 0.79 PTGS2 (0.41) PTGS2PTGS1PTGDR2
SCHEMBL8953581 0.77 PTGS2 (0.43) PTGS2PTGS1
SCHEMBL5141392 0.76 PTGS2 (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670533-A ANTIINFLAMMATORY AGENTS, ANALGESICS OR ANTIRHEUMATIC DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-23 US disclosed