SCHEMBL24679063

SCHEMBL24679063

Cc1cc(C(C)Nc2ccccc2C(O)O)c2oc(-c3nccnc3C)cc(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 19/20 0.53
▸ PIK3CB P42338 2/20 0.53
▸ PIK3CD O00329 1/20 0.53
▸ PIK3CG P48736 1/20 0.53
▸ MTOR P42345 1/20 0.47
▸ PRKDC P78527 1/20 0.47
▸ PIK3C3 Q8NEB9 1/20 0.47

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
SCHEMBL24680757 0.88 PIK3CA (0.66) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL24680676 0.79 PIK3CA (0.51) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL24679816 0.77 PIK3CA (0.68) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL24680533 0.77 PIK3CA (0.68) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL30322667 0.76 PIK3CA (0.63) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL24680669 0.75 PIK3CA (0.66) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL30090482 0.75 PIK3CA (0.66) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL24908857 0.75 PIK3CA (0.66) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL30090574 0.75 PIK3CA (0.63) PIK3CAPIK3CBMTORPRKDCPIK3C3
SCHEMBL23895590 0.75 PIK3CA (0.67) 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-2022235575-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION (US) 2022-11-10 — — WO disclosed
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