SCHEMBL25358550

SCHEMBL25358550

Cc1cc(C(C)Nc2ccccc2C(=O)O)c2nc(N3CCCCC3)n(C)c(=O)c2c1

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 9/20 0.83
▸ AKT2 P31751 9/20 0.83
▸ AKT3 Q9Y243 9/20 0.83
▸ PIK3CA P42336 11/20 0.61
▸ PIK3CB P42338 1/20 0.51
▸ MTOR P42345 1/20 0.51
▸ PRKDC P78527 1/20 0.51
▸ PIK3C3 Q8NEB9 1/20 0.51

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
SCHEMBL26042806 1.00 AKT1 (0.83) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30784105 1.00 AKT1 (0.83) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL26124939 1.00 AKT1 (0.83) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30784153 1.00 AKT1 (0.83) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL25358847 0.92 AKT1 (0.71) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30784555 0.92 AKT1 (0.76) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30784080 0.92 AKT1 (0.76) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30783759 0.92 AKT1 (0.76) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30783640 0.91 AKT1 (0.80) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL30784171 0.91 AKT1 (0.80) AKT1AKT2AKT3PIK3CA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023159155-A1 INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) AND USES THEREOF PIVALENT THERAPEUTICS, INC. (US) 2023-08-24 — — WO claimed
WO-2024026424-A1 QUINAZOLINONE DERIVATIVES AS AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-02-01 — — WO disclosed
WO-2023159155-A1 INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) AND USES THEREOF PIVALENT THERAPEUTICS, INC. (US) 2023-08-24 — — WO disclosed
WO-2023159155-A1 INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) AND USES THEREOF PIVALENT THERAPEUTICS, INC. (US) 2023-08-24 — — WO disclosed
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