SCHEMBL17457992

SCHEMBL17457992

CC(NC(=O)O)c1nc2cccc(OCC(=O)N3CCCCC3)c2c(=O)n1-c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.68
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PIK3CA P42336 2/20 0.45
PIK3CB P42338 2/20 0.45
PIK3CG P48736 2/20 0.45
VDAC2 P45880 1/20 0.43
SLC7A11 Q9UPY5 1/20 0.43

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
SCHEMBL17458208 0.92 PIK3CD (0.69) PIK3CDKMT2APIK3CAPIK3CBPIK3CG
SCHEMBL17458033 0.91 PIK3CD (0.69) PIK3CDMEN1KMT2APIK3CAPIK3CB
SCHEMBL17458426 0.89 PIK3CD (0.67) PIK3CDMEN1KMT2AVDAC2SLC7A11
SCHEMBL17458427 0.89 PIK3CD (0.67) PIK3CDMEN1KMT2AVDAC2SLC7A11
SCHEMBL17458343 0.86 PIK3CD (0.65) PIK3CDMEN1KMT2APIK3CAPIK3CB
SCHEMBL17458196 0.86 PIK3CD (0.65) PIK3CDMEN1KMT2APIK3CAPIK3CB
SCHEMBL17458332 0.85 PIK3CD (0.65) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17461936 0.82 PIK3CD (0.64) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17458462 0.82 PIK3CD (0.66) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL17461941 0.82 PIK3CD (0.64) PIK3CDMEN1KMT2APIK3CAPIK3CB

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 8/4885MEN1 1036/4885KMT2A 3788/4885
US-20160024054-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3R5, PIK3R4, PIK3CA PIK3CD 9/4885MEN1 1503/4885KMT2A 4128/4885

“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.