SCHEMBL30928402

SCHEMBL30928402

Cc1cc([C@@H](C)O)c2oc(-c3cnn(C)c3)c(C)c(=O)c2c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 1/20 0.37
▸ PIK3CA P42336 7/20 0.36
▸ AKT1 P31749 1/20 0.35
▸ AKT2 P31751 1/20 0.35
▸ AKT3 Q9Y243 1/20 0.35
▸ CDK2 P24941 6/20 0.34
▸ MAP4K1 Q92918 1/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ TTK P33981 1/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ INCENP Q9NQS7 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.32
▸ HSP90AB1 P08238 1/20 0.32
▸ CDK1 P06493 1/20 0.32
▸ CREBBP Q92793 1/20 0.32

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
SCHEMBL30928408 1.00 ACLY (0.37) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL30889635 0.89 ACLY (0.36) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL30928463 0.89 ACLY (0.36) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL27009554 0.89 AURKA (0.35) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL31481682 0.89 AURKA (0.35) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL26881431 0.89 AURKA (0.35) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL27008442 0.87 PIK3CA (0.44) PIK3CAAKT1AKT2AKT3MAP4K1
SCHEMBL27148738 0.87 PIK3CA (0.44) PIK3CAAKT1AKT2AKT3MAP4K1
SCHEMBL30889717 0.86 PIK3CA (0.38) ACLYPIK3CAAKT1AKT2AKT3
SCHEMBL30928420 0.84 KDM5B (0.37) PIK3CAAKT1AKT2AKT3

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-20240182460-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION 2024-06-06 — — 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-20240182460-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 ACLY 2561/4885PIK3CA 1/4885AKT1 13/4885

“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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