SCHEMBL5225534

SCHEMBL5225534

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

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 18/20 0.58
PTGS1 P23219 9/20 0.54
ABCC4 O15439 1/20 0.50
ABCB11 O95342 1/20 0.50
PDE4D Q08499 1/20 0.50
MAPK14 Q16539 1/20 0.50

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
SCHEMBL5223948 0.87 PTGS2 (0.56) PTGS2PTGS1ABCC4ABCB11PDE4D
SCHEMBL5223335 0.82 PTGS2 (0.51) PTGS2PTGS1ABCC4ABCB11PDE4D
SCHEMBL5210195 0.79 PTGS2 (0.82) PTGS2PTGS1ABCC4ABCB11PDE4D
SCHEMBL5229132 0.79 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL5207593 0.77 PTGS2 (0.69) PTGS2PTGS1ABCC4ABCB11PDE4D
SCHEMBL3947751 0.76 PTGS2 (0.61) PTGS2PTGS1ABCC4ABCB11PDE4D
SCHEMBL5223261 0.76 GSK3B (0.42)
SCHEMBL5052857 0.75 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL5226664 0.74 PTGS2 (0.48) PTGS2PTGS1MAPK14
SCHEMBL6725659 0.74 PTGS2 (1.00) 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