SCHEMBL13635875

SCHEMBL13635875

O=c1c(Br)c(OCc2ccc(F)c(F)c2)ccn1Cc1cccc(P)c1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.66
PDPK1 O15530 2/20 0.36
P2RX7 Q99572 1/20 0.36
HTR6 P50406 1/20 0.36

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
SCHEMBL13635186 0.89 MAPK14 (0.78) MAPK14
SCHEMBL4382379 0.89 MAPK14 (0.82) MAPK14
SCHEMBL13635874 0.87 MAPK14 (0.63) MAPK14
SCHEMBL4392919 0.82 MAPK14 (0.89) MAPK14
SCHEMBL4379163 0.79 MAPK14 (1.00) MAPK14
SCHEMBL4386801 0.79 MAPK14 (0.78) MAPK14
SCHEMBL4478817 0.79 MAPK14 (0.82) MAPK14
SCHEMBL4467417 0.78 MAPK14 (0.89) MAPK14
SCHEMBL4485643 0.77 MAPK14 (0.73) MAPK14
SCHEMBL4471003 0.77 MAPK14 (0.78) 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