SCHEMBL21143576

SCHEMBL21143576

COc1ncc(N2CCc3ncnc(OC4CCCN4C(=O)c4ccno4)c3C2)cc1C

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.74
PIK3CA P42336 20/20 0.74
PIK3CB P42338 1/20 0.55
PIK3CG P48736 1/20 0.55

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
SCHEMBL21143575 1.00 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL326981 0.85 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL327003 0.85 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL21143572 0.85 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL21143571 0.85 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20499895 0.84 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20499896 0.84 PIK3CD (0.74) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20499876 0.81 PIK3CD (0.75) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20499877 0.81 PIK3CD (0.75) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20499880 0.77 PIK3CD (0.75) PIK3CDPIK3CA

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-20190218217-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives as PI3Kdelta inhibitors NOVARTIS AG (CH) 2019-07-18 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-20190218217-A1 Tetrahydro-Pyrido-Pyrimidine Derivatives as PI3Kdelta inhibitors PIK3CA, PIK3CD, PIK3CB PIK3CD 2/4885PIK3CA 1/4885PIK3CB 3/4885

“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.