SCHEMBL13635196

SCHEMBL13635196

Cc1cc(CCc2c(F)cccc2F)c(Br)c(=O)n1-c1c(Cl)cccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.55
PKM P14618 3/20 0.40
CHRM5 P08912 1/20 0.39
NOTUM Q6P988 1/20 0.38
DAO P14920 1/20 0.38
KMT2A Q03164 1/20 0.37
PKLR P30613 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL4474784 0.85 MAPK14 (0.66) MAPK14CHRM5NOTUM
SCHEMBL4376201 0.79 MAPK14 (0.74) MAPK14
SCHEMBL4384792 0.72 MAPK14 (0.56) MAPK14NOTUM
SCHEMBL4377489 0.71 MAPK14 (1.00) MAPK14
SCHEMBL3523709 0.69 MAPK14 (0.48) MAPK14PKMKMT2A
SCHEMBL4377189 0.69 MAPK14 (1.00) MAPK14
SCHEMBL4465977 0.68 MAPK14 (0.57) MAPK14NOTUM
SCHEMBL4384354 0.67 MAPK14 (0.53) MAPK14NOTUM
SCHEMBL4376625 0.67 MAPK14 (1.00) MAPK14
SCHEMBL4379376 0.67 MAPK14 (0.72) 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
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed