SCHEMBL7840951

SCHEMBL7840951

CS(=O)(=O)c1ccc(-c2nc(NC(=O)c3cc(Cl)cc(Cl)c3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 16/20 0.58
PTGS1 P23219 2/20 0.52
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
USP2 O75604 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PIK3CD O00329 1/20 0.47
PIK3CA P42336 1/20 0.47
PIK3CB P42338 1/20 0.47
PIK3CG P48736 1/20 0.47

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
SCHEMBL7839881 1.00 PTGS2 (0.58) PTGS2PTGS1MEN1KMT2AUSP2
SCHEMBL7842692 0.91 KMT2A (0.60) PTGS2PTGS1MEN1KMT2AUSP2
SCHEMBL7842452 0.91 KMT2A (0.60) PTGS2PTGS1MEN1KMT2AUSP2
SCHEMBL7842268 0.91 PTGS2 (0.65) PTGS2PTGS1MEN1KMT2AUSP2
SCHEMBL7846521 0.91 PTGS2 (0.58) PTGS2PTGS1KMT2AUSP2L3MBTL1
SCHEMBL7845039 0.91 PTGS2 (0.58) PTGS2PTGS1KMT2AUSP2L3MBTL1
SCHEMBL7833908 0.90 PTGS2 (0.57) PTGS2PTGS1MEN1KMT2AL3MBTL1
SCHEMBL7846538 0.90 PTGS2 (0.57) PTGS2PTGS1MEN1KMT2AL3MBTL1
SCHEMBL7833741 0.90 PTGS2 (0.61) PTGS2PTGS1MEN1KMT2AUSP2
SCHEMBL7846092 0.90 PTGS2 (0.61) PTGS2PTGS1MEN1KMT2AUSP2

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