SCHEMBL1695189

SCHEMBL1695189

C[C@H](O)CNC(=O)c1cc2cc(F)ccc2nc1CCNc1ncnc(N)c1C#N

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.45
PIK3CG P48736 20/20 0.45
PIK3CB P42338 19/20 0.45
PIK3CA P42336 17/20 0.45
CYP3A4 P08684 4/20 0.43
PIK3R1 P27986 5/20 0.42

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
SCHEMBL1695193 1.00 PIK3CD (0.45) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694926 0.91 PIK3CD (0.50) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694717 0.89 PIK3CD (0.51) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694983 0.88 PIK3CD (0.48) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694851 0.87 PIK3CD (0.47) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694825 0.86 PIK3CD (0.44) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1695019 0.86 PIK3CD (0.44) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1695369 0.85 PIK3CD (0.45) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1695201 0.85 PIK3CD (0.40) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4
SCHEMBL1694861 0.84 PIK3CD (0.41) PIK3CDPIK3CGPIK3CBPIK3CACYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588467-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 EP disclosed
WO-2012003274-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed