SCHEMBL5207124

SCHEMBL5207124

CC(C)n1c(S(C)(=O)=O)nc(OCc2ccc(F)cc2F)c(Cl)c1=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.43
MAPK11 Q15759 1/20 0.41
SCN9A Q15858 1/20 0.38
MAPKAPK2 P49137 1/20 0.37
PTGER1 P34995 1/20 0.37

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
SCHEMBL5203583 0.88 MAPK14 (0.43) MAPK14
SCHEMBL5237979 0.86 MAPK14 (0.49) MAPK14MAPK11MAPKAPK2
SCHEMBL5204556 0.84 MAPK14 (0.47) MAPK14MAPK11MAPKAPK2
SCHEMBL5202334 0.82 MAPK14 (0.44) MAPK14MAPK11MAPKAPK2
SCHEMBL5206712 0.82 MAPK8 (0.42) MAPK14MAPK11SCN9A
SCHEMBL5241512 0.82 MAPK14 (0.43) MAPK14MAPK11
SCHEMBL5206500 0.81 MAPK14 (0.42) MAPK14MAPK11MAPKAPK2
SCHEMBL5207032 0.81 MAPK14 (0.47) MAPK14MAPK11
SCHEMBL5206853 0.80 MAPK14 (0.46) MAPK14MAPK11MAPKAPK2
SCHEMBL5209385 0.80 MAPK14 (0.44) MAPK14MAPK11MAPKAPK2

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-1802590-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES Pharmacia & Upjohn Company LLC (US) 2007-07-04 EP disclosed
WO-2006040666-A1 SUBSTITUTED N-ALKYLPYRIMIDINONES PHARMACIA & UPJOHN COMPANY LLC (US) 2006-04-20 WO disclosed