SCHEMBL5209259

SCHEMBL5209259

CC(C)n1c(OCCNC(N)=O)nc(OCc2ccc(F)cc2F)c(Br)c1=O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.46
MAPK11 Q15759 1/20 0.39

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
SCHEMBL5206024 0.92 MAPK14 (0.46) MAPK14MAPK11
SCHEMBL5205668 0.90 MAPK14 (0.47) MAPK14MAPK11
SCHEMBL5204817 0.89 MAPK14 (0.45) MAPK14MAPK11
SCHEMBL5233788 0.87 MAPK14 (0.43) MAPK14
SCHEMBL5209640 0.87 MAPK14 (0.47) MAPK14MAPK11
Trifluoroacetic Acid SCHEMBL5204473 0.86 MAPK14 (0.40) MAPK14
SCHEMBL5204566 0.85 MAPK14 (0.46) MAPK14MAPK11
SCHEMBL5204251 0.85 MAPK14 (0.41) MAPK14
SCHEMBL5205934 0.82 MAPK14 (0.46) MAPK14MAPK11
SCHEMBL5207590 0.81 MAPK14 (0.44) MAPK14

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