SCHEMBL10146906

SCHEMBL10146906

Cc1cc(CNC(=O)c2cc3c(F)cccc3nc2[C@H](C)Nc2ncnc(N)c2N)n(C)n1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.41
PIK3CB P42338 15/20 0.41
PIK3CG P48736 15/20 0.41
PIK3CA P42336 13/20 0.41
CYP3A4 P08684 4/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PIK3R2 O00459 3/20 0.36
PDPK1 O15530 1/20 0.36

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
SCHEMBL1695606 0.91 PIK3CD (0.52) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL1695602 0.91 PIK3CD (0.52) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL10146891 0.83 PIK3R2 (0.35) PIK3CDPIK3CGPIK3R2
SCHEMBL10147634 0.81 PIK3CD (0.51) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL10146956 0.81 PIK3CD (0.44) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL10147644 0.79 PIK3CD (0.42) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL1695027 0.78 PIK3CD (0.55) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL1695029 0.78 PIK3CD (0.55) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL14815292 0.77 PIK3CD (0.66) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4
SCHEMBL1695303 0.77 PIK3CD (0.66) PIK3CDPIK3CBPIK3CGPIK3CACYP3A4

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