SCHEMBL27385365

SCHEMBL27385365

Cc1cc2c(=O)cc(-c3ccncc3)oc2c(C(C)Nc2ccccc2C(=O)O)n1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 18/20 0.52
▸ PIK3CB P42338 2/20 0.52
▸ PIK3CD O00329 1/20 0.52
▸ PIK3CG P48736 1/20 0.52
▸ MTOR P42345 1/20 0.45
▸ PRKDC P78527 1/20 0.45
▸ PIK3C3 Q8NEB9 1/20 0.45
▸ CYP1A1 P04798 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ CFTR P13569 1/20 0.43
▸ CYP1B1 Q16678 1/20 0.43

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
SCHEMBL27383027 1.00 PIK3CA (0.52) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL27384001 1.00 PIK3CA (0.52) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
Trifluoroacetic Acid SCHEMBL30857932 0.95 PIK3CA (0.48) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30857904 0.88 PIK3CA (0.46) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30857976 0.88 PIK3CA (0.46) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30857944 0.88 PIK3CA (0.46) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL25219256 0.84 PIK3CA (0.74) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL30434657 0.84 PIK3CA (0.74) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL24912818 0.77 PIK3CA (0.72) PIK3CAPIK3CBPIK3CDPIK3CGMTOR
SCHEMBL24912829 0.77 PIK3CA (0.72) 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-2024081904-A1 METHODS FOR TREATING CANCER GENESIS THERAPEUTICS, INC. (US) 2024-04-18 — — WO disclosed
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