SCHEMBL5226664

SCHEMBL5226664

CS(=O)(=O)c1ccc(-c2nnc(Oc3ccc(F)cc3F)cc2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 16/20 0.48
MAPK14 Q16539 1/20 0.46
PTGS1 P23219 3/20 0.45
BRD4 O60885 2/20 0.43

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
SCHEMBL5224015 0.83 SLC6A4 (0.35) MAPK14PTGS1
SCHEMBL5223501 0.78 TRPA1 (0.44) MAPK14
SCHEMBL5222107 0.76 PTGS1 (0.39) PTGS2MAPK14PTGS1
SCHEMBL5225534 0.74 PTGS2 (0.58) PTGS2MAPK14PTGS1
SCHEMBL5226799 0.74 SYK (0.44) MAPK14
SCHEMBL5223948 0.73 PTGS2 (0.56) PTGS2MAPK14PTGS1
SCHEMBL5223530 0.73 MAPK14 (0.46) MAPK14
SCHEMBL5222047 0.72 SYK (0.42) PTGS2MAPK14
SCHEMBL5221631 0.71 SYK (0.42) MAPK14
SCHEMBL3943716 0.71 PTGS2 (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300399-B1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2007-08-22 EP disclosed
US-6664256-B1 Interleukin- 1 beta inhibitors KOWA CO., LTD. (JP) 2003-12-16 US disclosed
EP-1300399-A1 PHENYLPYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME Kowa Co., Ltd. (JP) 2003-04-09 EP disclosed