SCHEMBL24679875

SCHEMBL24679875

Cc1ccc(NC(C)c2cc(C)cc3c(=O)c(C)c(-c4cccnc4)oc23)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 18/20 0.53
▸ AKT1 P31749 1/20 0.52
▸ AKT2 P31751 1/20 0.52
▸ AKT3 Q9Y243 1/20 0.52
▸ PIK3CB P42338 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ PRKDC P78527 1/20 0.44
▸ PIK3C3 Q8NEB9 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
SCHEMBL24908609 0.93 PIK3CA (0.51) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL24908491 0.93 PIK3CA (0.56) PIK3CAAKT1AKT2AKT3
SCHEMBL30090441 0.93 PIK3CA (0.56) PIK3CAAKT1AKT2AKT3
SCHEMBL24680693 0.93 PIK3CA (0.56) PIK3CAAKT1AKT2AKT3
SCHEMBL24680907 0.93 PIK3CA (0.51) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL30742572 0.92 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL30090434 0.92 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL27008303 0.92 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL24680902 0.92 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL24908489 0.90 PIK3CA (0.50) PIK3CAAKT1AKT2AKT3PIK3CB

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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