SCHEMBL5284549

SCHEMBL5284549

O=C1c2ccc(Nc3ccc(F)cc3F)cc2CCN1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.58
GRM5 P41594 1/20 0.53

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
SCHEMBL5280862 0.89 MAPK14 (0.55) MAPK14
SCHEMBL5291388 0.88 MAPK14 (0.52) MAPK14
SCHEMBL5284312 0.85 MAPK14 (0.57) MAPK14
SCHEMBL7533063 0.84 GRM5 (0.67) GRM5
SCHEMBL15712413 0.80 GRM5 (0.51) MAPK14GRM5
SCHEMBL7535369 0.79 GRM5 (0.62) GRM5
SCHEMBL5280354 0.78 MAPK14 (0.57) MAPK14
SCHEMBL5286047 0.78 GRM5 (0.52) MAPK14GRM5
SCHEMBL15712412 0.77 GRM5 (0.48) MAPK14GRM5
SCHEMBL5282254 0.75 MAPK14 (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007000337-A1 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2007-01-04 WO claimed
WO-2007000337-A1 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2007-01-04 WO disclosed