SCHEMBL20404262

SCHEMBL20404262

CC(Nc1nc(N)nc(N)c1C#N)c1nc2cccc(N)c2c(=O)n1-c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.84
PIK3R1 P27986 10/20 0.84
PIK3CA P42336 2/20 0.84
PIK3CB P42338 2/20 0.84
PIK3CG P48736 2/20 0.84

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
SCHEMBL15815961 0.92 PIK3CD (0.83) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15817662 0.92 PIK3CD (0.83) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15815958 0.92 PIK3CD (0.83) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15817660 0.92 PIK3CD (0.83) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15816875 0.91 PIK3CD (0.84) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15816233 0.91 PIK3CD (0.81) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15816215 0.91 PIK3CD (0.81) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15816408 0.91 PIK3CD (1.00) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15817772 0.91 PIK3CD (0.81) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG
SCHEMBL15817301 0.91 PIK3CD (0.81) PIK3CDPIK3R1PIK3CAPIK3CBPIK3CG

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-2935246-B1 ISOQUINOLINONE OR QUINAZOLINONE PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD CALISTOGA LLC (US) 2018-07-25 EP disclosed