SCHEMBL10147652

SCHEMBL10147652

CC(=O)c1cc2cccc(Cl)c2nc1[C@H](C)Nc1ncnc(N)c1C#N

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.48
PIK3R2 O00459 14/20 0.48
PIK3CG P48736 8/20 0.48
PIK3CA P42336 3/20 0.48
PIK3CB P42338 3/20 0.48
PIK3R1 P27986 2/20 0.48
CYP3A4 P08684 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
SCHEMBL1694945 0.93 PIK3CD (0.50) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL14815289 0.93 PIK3CD (0.50) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL10147661 0.91 PIK3CD (0.52) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL1695240 0.91 PIK3CD (0.52) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL10147628 0.90 PIK3CD (0.54) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL1695133 0.90 PIK3CD (0.54) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL14815738 0.90 PIK3CD (0.53) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL14815737 0.90 PIK3CD (0.53) PIK3CDPIK3R2PIK3CGPIK3CAPIK3CB
SCHEMBL1695360 0.87 PIK3R2 (0.52) PIK3CDPIK3R2PIK3CG
SCHEMBL10147643 0.87 PIK3R2 (0.52) PIK3CDPIK3R2PIK3CG

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-2012003274-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed