SCHEMBL7846341

SCHEMBL7846341

NS(=O)(=O)c1ccc(-c2nc(C(=O)NCc3ccccc3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.53
PTGS2 P35354 10/20 0.53
PTGS1 P23219 5/20 0.53
CA1 P00915 3/20 0.52
KMT2A Q03164 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
TP53 P04637 1/20 0.48
MDM2 Q00987 1/20 0.48

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
SCHEMBL7839826 1.00 CA2 (0.53) CA2PTGS2PTGS1CA1KMT2A
SCHEMBL7845738 0.95 CA1 (0.54) CA2PTGS2PTGS1CA1KMT2A
SCHEMBL7832892 0.95 CA1 (0.54) CA2PTGS2PTGS1CA1KMT2A
SCHEMBL7845269 0.91 MAOB (0.52) CA2PTGS2PTGS1CA1CA12
SCHEMBL7841669 0.91 MAOB (0.52) CA2PTGS2PTGS1CA1CA12
SCHEMBL7842502 0.90 CA1 (0.55) CA2PTGS2PTGS1CA1CA12
SCHEMBL7846099 0.90 CA1 (0.55) CA2PTGS2PTGS1CA1CA12
SCHEMBL7845271 0.90 PTGS2 (0.53) CA2PTGS2PTGS1CA1KMT2A
SCHEMBL7846006 0.90 PTGS2 (0.52) CA2PTGS2PTGS1CA1CA12
SCHEMBL7839688 0.90 PTGS2 (0.53) CA2PTGS2PTGS1CA1KMT2A

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-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
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed