SCHEMBL5322684

SCHEMBL5322684

Cc1ccc(C(=O)NCC(O)C(=O)N(C)C)cc1-n1cnc(OCc2ccc(F)cc2F)c(Cl)c1=O

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.81
MAPK11 Q15759 4/20 0.75
ROCK2 O75116 1/20 0.45
MAPK12 P53778 1/20 0.45
STRADA Q7RTN6 1/20 0.45

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
SCHEMBL5322678 1.00 MAPK14 (0.81) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3518756 0.91 MAPK14 (0.87) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3524254 0.91 MAPK14 (0.87) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL5598553 0.91 MAPK14 (0.87) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3524779 0.89 MAPK14 (1.00) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3525363 0.89 MAPK14 (1.00) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3522500 0.86 MAPK14 (1.00) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL5317997 0.85 MAPK14 (0.60) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL5317994 0.85 MAPK14 (0.60) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3524735 0.85 MAPK14 (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007081901-A2 PYRIMIDINONE DERIVATIVES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2007-07-19 WO disclosed