SCHEMBL15623911

SCHEMBL15623911

CC(=O)c1cn2cc(-c3cnc(N)nc3)nc(N3CCOCC3)c2n1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 20/20 0.82
MTOR P42345 5/20 0.82
PIK3R1 P27986 11/20 0.63
PIK3CD O00329 1/20 0.58
PIK3CB P42338 1/20 0.58
PIK3CG P48736 1/20 0.58

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
SCHEMBL5559466 0.90 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL26078997 0.90 PIK3CA (0.84) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL15603034 0.89 PIK3CA (0.78) PIK3CAMTORPIK3R1PIK3CDPIK3CB
Lithium Ion SCHEMBL30366291 0.88 PIK3CA (0.81) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL26078996 0.84 PIK3CA (0.74) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL5559887 0.84 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL15603030 0.83 PIK3CA (0.69) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL15603170 0.83 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL30366589 0.83 PIK3CA (0.66) PIK3CAMTORPIK3R1PIK3CDPIK3CB
SCHEMBL15602962 0.82 PIK3CA (1.00) PIK3CAMTORPIK3R1PIK3CDPIK3CB

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-2419429-B1 IMIDAZOPYRAZINES AS INHIBITORS OF PROTEIN KINASES CT NAC INVESTIGACIONES ONCOLOGICAS CNIO (ES) 2014-03-26 EP disclosed