SCHEMBL30742387

SCHEMBL30742387

Cc1cc([C@@H](C)N)c2oc(-c3ncccc3F)c(C)c(=O)c2c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 5/20 0.35
▸ PIK3CB P42338 5/20 0.35
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ HSP90AB1 P08238 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ AKT1 P31749 1/20 0.31
▸ AKT2 P31751 1/20 0.31
▸ AKT3 Q9Y243 1/20 0.31
▸ CDK2 P24941 1/20 0.31

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
SCHEMBL27134817 1.00 PIK3CA (0.35) PIK3CAPIK3CBPIK3CDPIK3CGKDM4E
SCHEMBL26884316 1.00 PIK3CA (0.35) PIK3CAPIK3CBPIK3CDPIK3CGKDM4E
SCHEMBL27009738 0.86 POLB (0.34) PIK3CAPIK3CBPIK3CDPIK3CGPOLB
SCHEMBL26884305 0.86 POLB (0.34) PIK3CAPIK3CBPIK3CDPIK3CGPOLB
SCHEMBL30742437 0.86 POLB (0.34) PIK3CAPIK3CBPIK3CDPIK3CGPOLB
SCHEMBL27008367 0.86 PIK3CA (0.43) PIK3CAPIK3CBPIK3CDPIK3CGL3MBTL1
SCHEMBL27144559 0.86 PIK3CA (0.43) PIK3CAPIK3CBPIK3CDPIK3CGL3MBTL1
SCHEMBL27132890 0.84 PIK3CB (0.35) PIK3CAPIK3CBKDM4EAPAF1HSP90AA1
SCHEMBL26884633 0.84 PIK3CB (0.35) PIK3CAPIK3CBKDM4EAPAF1HSP90AA1
SCHEMBL26882190 0.83 PIK3CA (0.39) PIK3CAPIK3CBPIK3CDPIK3CGAKT1

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-20240018115-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2024-01-18 — — 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-20240018115-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 PIK3CA 1/4885PIK3CB 16/4885PIK3CD 6/4885

“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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