SCHEMBL7999520

SCHEMBL7999520

Cc1nccn1-c1nc(-c2cccc(N)c2C=N)nc(N2CCOCC2)n1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.61
MTOR P42345 17/20 0.61
PIK3R1 P27986 7/20 0.44
PIK3CB P42338 4/20 0.41
RICTOR Q6R327 4/20 0.41
RPTOR Q8N122 4/20 0.41
MAPKAP1 Q9BPZ7 4/20 0.41
MLST8 Q9BVC4 4/20 0.41
PIK3CG P48736 3/20 0.39
PIK3CD O00329 2/20 0.39
PIK3C2B O00750 1/20 0.38
PIK3C3 Q8NEB9 1/20 0.38
PI4KB Q9UBF8 1/20 0.38

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
SCHEMBL5886633 0.77 PIK3CA (0.57) PIK3CAMTORPIK3R1PIK3CBRICTOR
SCHEMBL8008565 0.76 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CBRICTOR
SCHEMBL8003220 0.76 PIK3CA (0.78) PIK3CAMTORPIK3R1PIK3CBPIK3CG
SCHEMBL8012933 0.75 PIK3CA (0.64) PIK3CAMTORPIK3R1PIK3CGPIK3CD
SCHEMBL7999531 0.74 PIK3CA (0.72) PIK3CAMTORPIK3R1PIK3CBRICTOR
SCHEMBL8012871 0.74 PIK3CA (0.79) PIK3CAMTORPIK3R1PIK3CBPIK3CG
SCHEMBL4018631 0.73 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CBPIK3CG
SCHEMBL19142285 0.73 PIK3CD (0.49) PIK3CAMTORPIK3R1PIK3CBPIK3CG
SCHEMBL1308989 0.72 PIK3CA (0.61) PIK3CAMTORPIK3R1PIK3CBPIK3CG
SCHEMBL4018233 0.72 PIK3CA (0.65) PIK3CAMTORPIK3R1PIK3CBPIK3CG

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