SCHEMBL30742402

SCHEMBL30742402

Cc1cc([C@@H](C)NC(=O)OC(C)(C)C)c2oc(-c3c(F)ccnc3F)c(C)c(=O)c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 6/20 0.35
▸ AAK1 Q2M2I8 2/20 0.34
▸ PIK3CB P42338 2/20 0.33
▸ AKT1 P31749 1/20 0.33
▸ AKT2 P31751 1/20 0.33
▸ AKT3 Q9Y243 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ FDPS P14324 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ NCOA2 Q15596 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
SCHEMBL26885800 1.00 PIK3CA (0.35) PIK3CAAAK1PIK3CBAKT1AKT2
SCHEMBL27009471 0.89 PIK3CA (0.40) PIK3CAPIK3CBAKT1AKT2AKT3
SCHEMBL27008467 0.89 PIK3CA (0.40) PIK3CAPIK3CBAKT1AKT2AKT3
SCHEMBL26881434 0.88 PIK3CA (0.36) PIK3CAPIK3CBAKT1AKT2AKT3
SCHEMBL30742321 0.88 PIK3CA (0.36) PIK3CAPIK3CBAKT1AKT2AKT3
SCHEMBL30742082 0.86 PIK3CA (0.38) PIK3CAAAK1PIK3CBAKT1AKT2
SCHEMBL26882184 0.86 PIK3CA (0.38) PIK3CAAAK1PIK3CBAKT1AKT2
SCHEMBL30741953 0.85 PIK3CA (0.38) PIK3CAAAK1PIK3CBAKT1AKT2
SCHEMBL30742224 0.85 PIK3CA (0.36) PIK3CAAAK1PIK3CBAKT1AKT2
SCHEMBL26881515 0.85 PIK3CA (0.38) PIK3CAAAK1PIK3CBAKT1AKT2

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 1/4885AAK1 401/4885PIK3CB 16/4885

“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.

Send feedback