SCHEMBL1695113

SCHEMBL1695113

Cc1nn(C)cc1CNC(=O)c1cc2cccc(Cl)c2nc1[C@H](C)Nc1ncnc(N)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3R2 O00459 17/20 0.44
PIK3CD O00329 14/20 0.44
PIK3CG P48736 6/20 0.44
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
ALDH1A1 P00352 1/20 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
SCHEMBL1695063 0.86 PIK3R2 (0.45) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL1695065 0.86 PIK3R2 (0.45) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL1695133 0.86 PIK3CD (0.54) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL10147628 0.86 PIK3CD (0.54) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL10146932 0.85 PIK3CD (0.50) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL1695308 0.85 PIK3CD (0.50) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL10147661 0.84 PIK3CD (0.52) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL1695240 0.84 PIK3CD (0.52) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL10147622 0.84 PIK3R2 (0.52) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB
SCHEMBL1695339 0.84 PIK3R2 (0.52) PIK3R2PIK3CDPIK3CGPIK3CAPIK3CB

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