SCHEMBL7844852

SCHEMBL7844852

CS(=O)(=O)c1ccccc1-c1nc(S(=O)(=O)c2cccc(F)c2)sc1-c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 0.48
PTGS1 P23219 3/20 0.47
ALOX5 P09917 1/20 0.41

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
SCHEMBL7841717 0.92 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7846444 0.92 PTGS2 (0.46) PTGS2PTGS1ALOX5
SCHEMBL7843104 0.92 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7845662 0.91 PTGS2 (0.51) PTGS2PTGS1ALOX5
SCHEMBL7840176 0.91 PTGS2 (0.48) PTGS2PTGS1ALOX5
SCHEMBL7845128 0.90 PTGS2 (0.53) PTGS2PTGS1ALOX5
SCHEMBL7840425 0.87 PTGS2 (0.50) PTGS2PTGS1ALOX5
SCHEMBL7845216 0.86 PTGS2 (0.49) PTGS2PTGS1ALOX5
SCHEMBL7842993 0.85 PTGS2 (0.51) PTGS2PTGS1ALOX5
SCHEMBL7839941 0.85 PTGS2 (0.54) 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-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed