SCHEMBL13635208

SCHEMBL13635208

CCOC(=O)c1ccc(-n2c(C)cc(CCc3ccc(F)cc3F)c(Br)c2=O)nc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.51
ROCK2 O75116 1/20 0.44
MAPK12 P53778 1/20 0.44
MAPK11 Q15759 1/20 0.44
STRADA Q7RTN6 1/20 0.44

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
SCHEMBL4376964 0.88 MAPK14 (0.68) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL3519062 0.81 MAPK14 (0.49) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4376675 0.77 MAPK14 (0.72) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4384595 0.75 MAPK14 (0.77) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL25529131 0.71 KDM4E (0.41) MAPK14
SCHEMBL4376681 0.70 MAPK14 (0.82) MAPK14
SCHEMBL29594186 0.69 MAPK14 (0.70) MAPK14
SCHEMBL4376084 0.69 MAPK14 (0.70) MAPK14
SCHEMBL3525360 0.69 MAPK14 (0.59) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL3524650 0.67 MAPK14 (0.59) 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