SCHEMBL6866772

SCHEMBL6866772

COc1cc(-c2cccc(F)c2Cl)c2c(c1)N(c1c(Cl)cccc1Cl)C(=O)NC2

nearest known ligand 0.79

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.79
KCNH2 Q12809 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
SCHEMBL6669680 0.88 MAPK14 (1.00) MAPK14
SCHEMBL6667213 0.87 MAPK14 (1.00) MAPK14KCNH2
SCHEMBL6669033 0.86 MAPK14 (1.00) MAPK14
SCHEMBL6668342 0.80 MAPK14 (0.73) MAPK14
SCHEMBL6672721 0.73 MAPK14 (0.71) MAPK14
SCHEMBL6647374 0.72 MAPK14 (1.00) MAPK14
SCHEMBL6867299 0.72 MAPK14 (0.66) MAPK14KCNH2
SCHEMBL6667920 0.72 MAPK14 (0.71) MAPK14
SCHEMBL6672641 0.72 MAPK14 (0.79) MAPK14
SCHEMBL6664106 0.72 MAPK14 (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6809199-B2 ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES MERCK & CO., INC. 2004-10-26 US disclosed