SCHEMBL17458427

SCHEMBL17458427

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

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.67
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
POLB P06746 1/20 0.45
VDAC2 P45880 1/20 0.44
SLC7A11 Q9UPY5 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL17458426 1.00 PIK3CD (0.67) PIK3CDMEN1KMT2APOLBVDAC2
SCHEMBL17458199 0.92 PIK3CD (0.67) PIK3CDKMT2AKDM4EALDH1A1LMNA
SCHEMBL17458201 0.92 PIK3CD (0.67) PIK3CDKMT2AKDM4EALDH1A1LMNA
SCHEMBL17458478 0.91 PIK3CD (0.68) PIK3CDMEN1KMT2AVDAC2SLC7A11
SCHEMBL17458479 0.91 PIK3CD (0.68) PIK3CDMEN1KMT2AVDAC2SLC7A11
SCHEMBL17457992 0.89 PIK3CD (0.68) PIK3CDMEN1KMT2AVDAC2SLC7A11
SCHEMBL17458125 0.85 PIK3CD (0.64) PIK3CD
SCHEMBL17458123 0.85 PIK3CD (0.64) PIK3CD
SCHEMBL17458349 0.83 PIK3CD (0.66) PIK3CD
SCHEMBL17458105 0.83 PIK3CD (0.66) PIK3CD

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.