SCHEMBL20499858

SCHEMBL20499858

COc1ccc(N2CCc3ncnc(O[C@H]4CCN(C(=O)C5CC(OC)C5)C4)c3C2)cn1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 20/20 0.81
▸ PIK3CA P42336 20/20 0.81
▸ PIK3CB P42338 3/20 0.78
▸ PIK3CG P48736 1/20 0.61

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
SCHEMBL20499861 1.00 PIK3CD (0.81) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL404353 0.90 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL323009 0.90 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL322724 0.86 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL321791 0.86 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19350222 0.82 PIK3CD (0.68) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19350223 0.79 PIK3CD (0.65) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL322686 0.79 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL322687 0.79 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL21169570 0.78 PIK3CD (0.87) PIK3CDPIK3CAPIK3CB

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-20180265509-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives NOVARTIS AG (CH) 2018-09-20 — — 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-20180265509-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives PIK3CA, TYMP, TYMS PIK3CD 6/4885PIK3CA 1/4885PIK3CB 5/4885

“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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