SCHEMBL3628882

SCHEMBL3628882

COCCN1C(=O)CC(NC(=O)c2ccc(C)c(-n3cnc(OCc4ccc(F)cc4F)c(Cl)c3=O)c2)C1=O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.65
MAPK11 Q15759 4/20 0.65
ROCK2 O75116 1/20 0.41
MAPK12 P53778 1/20 0.41
STRADA Q7RTN6 1/20 0.41
GAA P10253 2/20 0.38

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
SCHEMBL13287434 1.00 MAPK14 (0.65) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2851801 1.00 MAPK14 (0.65) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2851945 0.94 MAPK14 (0.70) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2851949 0.94 MAPK14 (0.70) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL13287648 0.94 MAPK14 (0.70) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2853787 0.91 MAPK14 (0.69) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL13287495 0.91 MAPK14 (0.69) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2853790 0.91 MAPK14 (0.69) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2846973 0.88 MAPK14 (0.65) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL2846978 0.88 MAPK14 (0.65) MAPK14MAPK11ROCK2MAPK12STRADA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2166857-A1 KINASE INHIBITOR COMPOUNDS Xcovery, INC. (US) 2010-03-31 EP disclosed
WO-2008153942-A1 KINASE INHIBITOR COMPOUNDS XCOVERY, INC. (US) 2008-12-18 WO disclosed
WO-2008153942-A1 KINASE INHIBITOR COMPOUNDS XCOVERY, INC. (US) 2008-12-18 WO disclosed