SCHEMBL16843367

SCHEMBL16843367

CCN1CC(C(=O)N2CC=C(c3c(C(C)n4nc(-c5cc(O)cc(F)c5)c5c(N)ncnc54)oc(=O)c4ccccc34)CC2)C1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 19/20 0.47
▸ PIK3CB P42338 16/20 0.47
▸ PIK3CA P42336 11/20 0.47
▸ PIK3CG P48736 10/20 0.47
▸ ABL1 P00519 1/20 0.44
▸ EGFR P00533 1/20 0.44
▸ HCK P08631 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ EPHB4 P54760 1/20 0.44
▸ PRKDC P78527 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44

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
SCHEMBL16783576 0.94 PIK3CD (0.49) PIK3CDPIK3CBPIK3CAPIK3CGABL1
Formic Acid SCHEMBL16783472 0.91 PIK3CD (0.47) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL16783831 0.91 PIK3CD (0.47) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL16783887 0.91 PIK3CD (0.47) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL16783729 0.90 PIK3CD (0.48) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL16843404 0.89 PIK3CD (0.49) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL16783619 0.89 PIK3CD (0.49) PIK3CDPIK3CBPIK3CAPIK3CGABL1
SCHEMBL21327915 0.89 PIK3CD (0.51) PIK3CDPIK3CBPIK3CAPIK3CGABL1
Formic Acid SCHEMBL16783699 0.89 PIK3CD (0.46) PIK3CDPIK3CBPIK3CAPIK3CGABL1
Formic Acid SCHEMBL16783744 0.89 PIK3CD (0.45) PIK3CDPIK3CBPIK3CAPIK3CGABL1

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-2015091685-A1 ISOCHROMENE DERIVATIVES AS PHOSPHOINOSITIDE 3-KINASES INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2015-06-25 — — WO disclosed
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