SCHEMBL8637748

SCHEMBL8637748

CS(=O)(=O)c1ccc(-c2[nH]nc(Cl)c2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 18/20 0.56
PTGS1 P23219 8/20 0.53

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
SCHEMBL8067283 0.87 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL8640822 0.85 PTGS2 (0.49) PTGS2PTGS1
SCHEMBL8069284 0.82 PTGS2 (0.53) PTGS2PTGS1
SCHEMBL6438544 0.82 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL8068397 0.80 PTGS2 (0.53) PTGS2
SCHEMBL8195776 0.80 CA2 (0.41) PTGS2PTGS1
SCHEMBL8058037 0.79 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL8196010 0.78 CA2 (0.43) PTGS2PTGS1
SCHEMBL8187580 0.78 TP53 (0.37) PTGS2PTGS1
SCHEMBL7779618 0.77 PTGS2 (0.57) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0856000-A1 1,3,5-TRISUBSTITUTED PYRAZOLES FOR TREAMENT OF INFLAMMATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-08-05 EP disclosed
WO-1997013755-A1 1,3,5-TRISUBSTITUTED PYRAZOLES FOR TREAMENT OF INFLAMMATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-04-17 WO disclosed