SCHEMBL8010409

SCHEMBL8010409

CCCCc1nc2ccccc2n1-c1nc(-c2cnc(N)nc2)nc(N2CCOCC2)n1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 11/20 0.57
MTOR P42345 9/20 0.57
PIK3R1 P27986 5/20 0.57
PIK3CB P42338 11/20 0.56
PIK3CD O00329 4/20 0.52
PIK3CG P48736 4/20 0.52
PIK3C2B O00750 1/20 0.47

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
SCHEMBL8012368 0.94 PIK3CA (0.60) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL8015931 0.91 PIK3CA (0.62) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL7999518 0.84 PIK3CA (0.74) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL8008731 0.81 PIK3CB (0.76) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL993492 0.80 PIK3CB (0.76) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL8012490 0.79 PIK3CA (0.69) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL8010379 0.78 PIK3CA (0.59) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL1308957 0.76 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL8009906 0.75 PIK3CA (0.71) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL12950149 0.73 PIK3CB (1.00) PIK3CAMTORPIK3R1PIK3CBPIK3CD

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