SCHEMBL17330832

SCHEMBL17330832

CCC(Nc1nc(N)nc(N)c1C#N)c1nc2c(F)ccc(Cl)c2c(=O)n1N1CCN(Cc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 1.00
PIK3R2 O00459 15/20 1.00
PIK3R1 P27986 1/20 0.63
PIK3CA P42336 1/20 0.63
PIK3CB P42338 1/20 0.63
PIK3CG P48736 1/20 0.63

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
SCHEMBL17330829 1.00 PIK3CD (1.00) PIK3CDPIK3R2PIK3R1PIK3CAPIK3CB
SCHEMBL17330512 0.92 PIK3CD (1.00) PIK3CDPIK3R2PIK3CBPIK3CG
SCHEMBL17330509 0.92 PIK3CD (1.00) PIK3CDPIK3R2PIK3CBPIK3CG
SCHEMBL17330938 0.88 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17330941 0.88 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17330638 0.85 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17330640 0.85 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17331029 0.85 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17331030 0.85 PIK3CD (1.00) PIK3CDPIK3R2
SCHEMBL17338440 0.82 PIK3CD (0.72) PIK3CDPIK3R2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3154958-B1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES INC (US) 2020-10-07 EP claimed
US-10092563-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2018-10-09 US claimed
US-20150361054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2015-12-17 US claimed
EP-3154958-B1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES INC (US) 2020-10-07 EP disclosed
US-10092563-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2018-10-09 US disclosed
US-20150361054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2015-12-17 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 (2 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-20150361054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, AKT3, PIK3CB PIK3CD 5/4885PIK3R2 22/4885PIK3R1 20/4885
US-10092563-B2 Phosphatidylinositol 3-kinase inhibitors PIK3CA, AKT3, PIK3CB PIK3CD 5/4885PIK3R2 22/4885PIK3R1 20/4885

“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.