SCHEMBL17458292

SCHEMBL17458292

C[C@H](N)c1nc2cccc(CCCC3CCCCC3)c2c(=O)n1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.67
PIK3CB P42338 1/20 0.42
PIK3CG P48736 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
PDE7A Q13946 1/20 0.41

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
SCHEMBL17458295 1.00 PIK3CD (0.67) PIK3CDPIK3CBPIK3CGHDAC6PDE7A
SCHEMBL17458223 0.88 PIK3CD (0.65) PIK3CDPIK3CBPIK3CGHDAC6
SCHEMBL23912240 0.85 PIK3CD (0.55) PIK3CDPIK3CBPIK3CGHDAC6PDE7A
SCHEMBL17461952 0.84 PIK3CD (0.61) PIK3CDPIK3CBPIK3CG
SCHEMBL19924358 0.83 PIK3CD (0.67) PIK3CD
SCHEMBL19924360 0.83 PIK3CD (0.67) PIK3CD
SCHEMBL17458267 0.83 PIK3CD (0.67) PIK3CD
SCHEMBL17458265 0.83 PIK3CD (0.67) PIK3CD
SCHEMBL17458224 0.82 PIK3CD (0.64) PIK3CDPIK3CBPIK3CGHDAC6
SCHEMBL17458227 0.82 PIK3CD (0.64) PIK3CDPIK3CBPIK3CGHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3160960-B1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES INC (US) 2021-10-13 EP disclosed
US-20180065953-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-03-08 US disclosed
US-9765060-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2017-09-19 US disclosed
US-20160024054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES, INC. 2016-01-28 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-20180065953-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, PIK3R5, PIK3R4 PIK3CD 8/4885PIK3CB 14/4885PIK3CG 13/4885
US-20160024054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3R5, PIK3R4, PIK3CA PIK3CD 9/4885PIK3CB 22/4885PIK3CG 19/4885

“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.