SCHEMBL13635917

SCHEMBL13635917

Bc1c(OCc2ccc(F)cc2F)cc(C)n(-c2cc(N)ccc2F)c1=O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.55
ROCK2 O75116 1/20 0.48
MAPK12 P53778 1/20 0.48
MAPK11 Q15759 1/20 0.48
STRADA Q7RTN6 1/20 0.48

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
SCHEMBL4377613 0.88 MAPK14 (0.70) MAPK14ROCK2MAPK12MAPK11STRADA
Hydrochloric Acid SCHEMBL4377960 0.87 MAPK14 (0.69) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL13635341 0.79 MAPK14 (0.68) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL13635922 0.78 MAPK14 (0.64) MAPK14
SCHEMBL13635212 0.78 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL4381608 0.77 MAPK14 (0.65) MAPK14
SCHEMBL13635319 0.77 MAPK14 (0.60) MAPK14
SCHEMBL13635221 0.76 MAPK14 (0.49) MAPK14
SCHEMBL13635607 0.76 MAPK14 (0.49) MAPK14ROCK2MAPK12MAPK11STRADA
Hydrochloric Acid SCHEMBL4374293 0.76 MAPK14 (0.64) 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