SCHEMBL7844202

SCHEMBL7844202

CS(=O)(=O)c1ccccc1-c1nc(C(=O)Nc2cccc(Cl)c2)sc1-c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
PTGS2 P35354 6/20 0.43
ADORA3 P0DMS8 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
PTGS1 P23219 2/20 0.42
F10 P00742 1/20 0.42
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
MAPT P10636 3/20 0.40
ATM Q13315 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RAB9A P51151 2/20 0.40

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
SCHEMBL7842580 0.93 PTGS2 (0.43) L3MBTL1PTGS2ADORA3ADORA2AADORA2B
SCHEMBL7832325 0.93 PTGS2 (0.45) PTGS2LMNASMN1; SMN2PTGS1F10
SCHEMBL7842512 0.92 ESRRG (0.48) PTGS2LMNASMN1; SMN2PTGS1KMT2A
SCHEMBL7842757 0.90 PTGS2 (0.46) PTGS2PTGS1F10KMT2AMEN1
SCHEMBL7842353 0.90 NPC1 (0.48) PTGS2SMN1; SMN2PTGS1KMT2AMEN1
SCHEMBL7845585 0.89 GRM5 (0.43) PTGS2LMNASMN1; SMN2PTGS1KMT2A
SCHEMBL7841016 0.89 PTGS2 (0.46) PTGS2SMN1; SMN2PTGS1KMT2AMEN1
SCHEMBL7845840 0.88 NPSR1 (0.45) PTGS2PTGS1MAPTNPSR1RAB9A
SCHEMBL7842577 0.86 PTGS2 (0.56) PTGS2ADORA3ADORA2AADORA2BADORA1
SCHEMBL7844200 0.86 PTGS2 (0.56) PTGS2ADORA3ADORA2AADORA2BADORA1

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