SCHEMBL7999965

SCHEMBL7999965

Cc1ccn(-c2nc(-c3ccc(N)nc3)nc(N3CCOCC3)n2)n1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 19/20 0.74
MTOR P42345 17/20 0.74
PIK3R1 P27986 10/20 0.74
PIK3CD O00329 2/20 0.47
PIK3CG P48736 2/20 0.47
PARP1 P09874 1/20 0.47
RICTOR Q6R327 2/20 0.45
RPTOR Q8N122 2/20 0.45
MAPKAP1 Q9BPZ7 2/20 0.45
MLST8 Q9BVC4 2/20 0.45
PIK3CB P42338 1/20 0.44

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
SCHEMBL8009166 0.89 PIK3CA (0.70) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL1309506 0.86 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL8001512 0.84 PIK3CA (0.69) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL8012142 0.82 PIK3CA (0.72) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL29434910 0.79 PIK3CA (0.85) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL18193210 0.79 PIK3CA (0.85) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL16908138 0.78 PIK3CA (0.82) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL8008941 0.78 MTOR (0.65) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL18771918 0.77 PIK3CA (0.77) PIK3CAMTORPIK3R1PIK3CDPIK3CG
SCHEMBL8009906 0.77 PIK3CA (0.71) PIK3CAMTORPIK3R1PIK3CDPIK3CG

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-2009093981-A1 TRIAZINE COMPOUNDS AS KINASE INHIBITORS S BIO PTE LTD (SG) 2009-07-30 WO disclosed