SCHEMBL25677261

SCHEMBL25677261

Cc1cc(C(C)Nc2ccccc2C)c2oc(-c3ccc4cnccc4c3)cc(=O)c2c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 13/20 0.60
▸ PIK3CB P42338 4/20 0.60
▸ PIK3CD O00329 1/20 0.60
▸ PIK3CG P48736 1/20 0.60
▸ CSNK2A2 P19784 4/20 0.42
▸ CSNK2B P67870 4/20 0.42
▸ CSNK2A1 P68400 4/20 0.42
▸ MTOR P42345 1/20 0.42
▸ PRKDC P78527 1/20 0.42
▸ PIK3C3 Q8NEB9 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
SCHEMBL25220514 0.89 PIK3CA (0.59) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL25683186 0.88 PIK3CA (0.54) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL29202688 0.79 PIK3CA (0.62) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL30322285 0.79 PIK3CA (0.62) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL29202712 0.78 PIK3CA (0.51) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL910282 0.78 PIK3CA (0.75) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30322406 0.76 PIK3CA (0.57) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL25677257 0.76 PIK3CA (0.54) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30434657 0.76 PIK3CA (0.74) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL25219256 0.76 PIK3CA (0.74) PIK3CAPIK3CBPIK3CDPIK3CGMTOR

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-2023104111-A1 FUSED HETEROCYCLIC COMPOUNDS AS PI3KALPHA INHIBITORS NANJING ZENSHINE PHARMACEUTICALS CO., LTD. (CN) 2023-06-15 — — WO disclosed
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