SCHEMBL5208575

SCHEMBL5208575

CC(C)n1cnc(OCc2ccc(F)cc2F)c(Cl)c1=O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.53
MAPK11 Q15759 3/20 0.51
MAOB P27338 1/20 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
SCHEMBL5204044 0.86 MAPK14 (0.51) MAPK14
SCHEMBL5237979 0.81 MAPK14 (0.49) MAPK14MAPK11
SCHEMBL5204556 0.79 MAPK14 (0.47) MAPK14MAPK11MAOB
SCHEMBL3519689 0.78 MAPK14 (0.48) MAPK14MAPK11
SCHEMBL5202380 0.77 MAOB (0.42) MAPK14MAOB
SCHEMBL5202334 0.77 MAPK14 (0.44) MAPK14MAPK11
SCHEMBL5241512 0.76 MAPK14 (0.43) MAPK14MAPK11
SCHEMBL5207124 0.76 MAPK14 (0.43) MAPK14MAPK11
SCHEMBL3518553 0.76 MAPK14 (0.57) MAPK14MAPK11
SCHEMBL3521424 0.76 MAPK14 (0.58) MAPK14MAPK11

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