SCHEMBL1310153

SCHEMBL1310153

Fc1cc(-c2nc(N3CCOCC3)c3oc4ccccc4c3n2)c2cc[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.57
PIK3CA P42336 14/20 0.57
PIK3CB P42338 12/20 0.57
PIK3CG P48736 12/20 0.57
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
ATR Q13535 2/20 0.49
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.46

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
SCHEMBL1311889 0.88 PIK3CA (0.55) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL1309826 0.87 PIK3CD (0.75) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL1311569 0.86 PIK3CA (0.77) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL1310490 0.86 LMNA (0.53) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL1309354 0.82 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL1309869 0.80 PIK3CA (0.58) PIK3CDPIK3CAPIK3CBPIK3CGLMNA
SCHEMBL18553652 0.80 PIK3CA (0.62) PIK3CDPIK3CAPIK3CBPIK3CGATR
SCHEMBL1308458 0.79 ATR (0.59) PIK3CDPIK3CAATRCYP3A4
SCHEMBL1311592 0.78 PIK3CD (0.60) PIK3CDPIK3CAPIK3CBPIK3CGATR
SCHEMBL1310913 0.76 PIK3CA (0.58) PIK3CDPIK3CAPIK3CBPIK3CGLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921361-B2 Triazine, pyrimidine and pyridine analogs and their use as therapeutic agents and diagnostic probes UNIVERSITY OF BASEL (CH) 2014-12-30 US disclosed
US-8921361-B2 Triazine, pyrimidine and pyridine analogs and their use as therapeutic agents and diagnostic probes UNIVERSITY OF BASEL (CH) 2014-12-30 US disclosed
US-8921361-B2 Triazine, pyrimidine and pyridine analogs and their use as therapeutic agents and diagnostic probes UNIVERSITY OF BASEL (CH) 2014-12-30 US disclosed
US-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIVERSITY OF BASEL (CH) 2011-11-10 US disclosed
US-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIVERSITY OF BASEL (CH) 2011-11-10 US disclosed
US-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIVERSITY OF BASEL (CH) 2011-11-10 US disclosed
WO-2010052569-A2 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIVERSITY OF BASEL (CH) 2010-05-14 WO 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-20110275762-A1 TRIAZINE, PYRIMIDINE AND PYRIDINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES MTOR, PIK3CA, PIK3CD PIK3CD 3/4885PIK3CA 2/4885PIK3CB 7/4885

“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.