SCHEMBL14214732

SCHEMBL14214732

NC(=O)c1cccc(Nc2ncnc(-n3c(N)nc4ccccc43)n2)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.59
PIK3CA P42336 5/20 0.56
MTOR P42345 5/20 0.56
PIK3CD O00329 2/20 0.56
PIK3CB P42338 2/20 0.56
PIK3CG P48736 2/20 0.56
ROCK1 Q13464 1/20 0.46

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
SCHEMBL14214728 0.90 MKNK1 (0.53) SCN9APIK3CAMTORPIK3CDPIK3CB
SCHEMBL6479199 0.86 PIK3CA (0.52) SCN9APIK3CAMTORPIK3CDPIK3CB
SCHEMBL14380902 0.84 MKNK1 (0.55) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL14214627 0.81 AURKA (0.48) PIK3CAMTOR
SCHEMBL6478730 0.80 KDR (0.77) SCN9APIK3CAMTORPIK3CDPIK3CB
SCHEMBL3244139 0.80 PIK3CA (0.55) SCN9APIK3CAMTORPIK3CDPIK3CB
SCHEMBL14214617 0.78 KDR (0.53) SCN9APIK3CAMTOR
SCHEMBL6479848 0.77 PIK3CA (0.54) PIK3CAMTORPIK3CDPIK3CBPIK3CG
SCHEMBL14214626 0.76 CDK1 (0.47) PIK3CAMTOR
SCHEMBL14214621 0.76 KDR (0.57) PIK3CAMTORPIK3CDPIK3CBPIK3CG

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-1218360-B1 TRIAZINE KINASE INHIBITORS AMGEN INC (US) 2008-05-28 EP disclosed