SCHEMBL31516583

SCHEMBL31516583

Cc1cc([C@@H](C)Nc2ccccc2C(=O)OC(C)(C)C)c2oc(-c3ccnc(N4CCOCC4)c3)c(C)c(=O)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 17/20 0.49
▸ AKT1 P31749 1/20 0.48
▸ AKT2 P31751 1/20 0.48
▸ AKT3 Q9Y243 1/20 0.48
▸ PIK3CB P42338 6/20 0.46
▸ PIK3CD O00329 2/20 0.44
▸ PIK3CG P48736 2/20 0.44
▸ SRC P12931 1/20 0.44
▸ DDX6 P26196 1/20 0.44
▸ PDE4A P27815 1/20 0.44
▸ CSK P41240 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ PLK1 P53350 1/20 0.44
▸ PRKDC P78527 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4C Q08493 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44
▸ HDAC6 Q9UBN7 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
SCHEMBL31115289 1.00 PIK3CA (0.49) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL25679403 0.90 PIK3CA (0.61) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL25273943 0.90 PIK3CA (0.61) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL24912953 0.83 PIK3CA (0.55) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL25680462 0.83 AKT1 (0.51) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL31516535 0.81 AKT1 (0.50) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL31516536 0.81 AKT1 (0.50) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL30742470 0.81 PIK3CA (0.50) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL25683216 0.81 PIK3CA (0.56) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL25683213 0.81 PIK3CA (0.56) 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
US-20250136568-A1 FUSED HETEROCYCLIC COMPOUNDS AS PI3KALPHA INHIBITORS NANJING ZENSHINE PHARMACEUTICALS CO., LTD. (CN) 2025-05-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250136568-A1 FUSED HETEROCYCLIC COMPOUNDS AS PI3KALPHA INHIBITORS PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885AKT1 16/4885AKT2 15/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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