SCHEMBL25867142

SCHEMBL25867142

C[C@@H]1COCCN1c1cc(OC(C)(C)C)nc(N2CCN([SH](=O)=O)CC2C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 19/20 0.46
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37

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
SCHEMBL19259477 0.87 PIK3C3 (0.58) PIK3C3PIK3CAPIK3CBPIK3CG
SCHEMBL20765439 0.87 PIK3C3 (0.62) PIK3C3PDCD1CD274
SCHEMBL19276422 0.87 PIK3C3 (0.53) PIK3C3PIK3CAPIK3CBPIK3CG
SCHEMBL19259449 0.87 PIK3C3 (0.53) PIK3C3PIK3CAPIK3CBPIK3CG
SCHEMBL24224332 0.85 PIK3C3 (0.45) PIK3C3PDCD1CD274
SCHEMBL20765445 0.85 PIK3C3 (0.51) PIK3C3PDCD1CD274
SCHEMBL20765566 0.85 PIK3C3 (0.53) PIK3C3PDCD1CD274
SCHEMBL20777081 0.85 PIK3C3 (0.51) PIK3C3PDCD1CD274
SCHEMBL20765501 0.85 PIK3C3 (0.53) PIK3C3PIK3CAPIK3CBPIK3CG
SCHEMBL20765346 0.84 PIK3C3 (0.51) PIK3C3PDCD1CD274

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-20230234949-A1 MORPHOLINYLPYRIDONE COMPOUNDS SPRINT BIOSCIENCE AB (SE) 2023-07-27 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-20230234949-A1 MORPHOLINYLPYRIDONE COMPOUNDS MAP1B, RRP12, MYT1 PIK3C3 3821/4885PIK3CA 3744/4885PIK3CB 4197/4885

“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.