SCHEMBL4101759

SCHEMBL4101759

CC(Nc1ncnc(N)c1C#N)c1cnc2c(F)cccc2c1-c1cccc(F)c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.63
PIK3CD O00329 19/20 0.61
PIK3CG P48736 11/20 0.57
PIK3CA P42336 7/20 0.54
PIK3CB P42338 7/20 0.54
CYP3A4 P08684 3/20 0.50
PIK3R2 O00459 1/20 0.49
PIK3R1 P27986 1/20 0.49

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
SCHEMBL15437086 1.00 BCL2 (0.63) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL2717646 1.00 BCL2 (0.63) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL15437121 1.00 BCL2 (0.63) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL15437043 0.94 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL2717952 0.94 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL2718348 0.94 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL15437079 0.92 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL2718677 0.92 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL15437048 0.92 PIK3CD (0.57) BCL2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL4104175 0.91 BCL2 (0.69) BCL2PIK3CDPIK3CGPIK3CAPIK3CB

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-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 WO disclosed