SCHEMBL6471933

SCHEMBL6471933

Cc1cc(OCc2ccc(F)cc2F)c(Br)c(=O)n1-c1ccc(Br)cc1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.65
ROCK2 O75116 1/20 0.63
MAPK12 P53778 1/20 0.63
MAPK11 Q15759 1/20 0.63
STRADA Q7RTN6 1/20 0.63

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
SCHEMBL6500876 0.92 MAPK14 (0.67) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6502960 0.92 MAPK14 (0.69) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6502516 0.90 MAPK14 (0.77) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6471643 0.88 MAPK14 (0.61) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6526042 0.87 MAPK14 (0.59) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4378309 0.86 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4376140 0.86 MAPK14 (0.82) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4380858 0.86 MAPK14 (0.73) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL5862287 0.85 MAPK14 (0.82) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6474998 0.84 MAPK14 (0.77) MAPK14ROCK2MAPK12MAPK11STRADA

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-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO claimed