SCHEMBL1311249

SCHEMBL1311249

CS(=O)(=O)c1nc2nc(-c3cnc(N)nc3)nc(N3CCOCC3)c2s1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTOR P42345 12/20 0.59
PIK3CA P42336 17/20 0.58
PIK3CB P42338 10/20 0.57
PIK3CD O00329 8/20 0.57
PIK3CG P48736 8/20 0.57
RPTOR Q8N122 1/20 0.55
MLST8 Q9BVC4 1/20 0.55
SYK P43405 1/20 0.55
MAP3K9 P80192 1/20 0.55

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
SCHEMBL1310436 0.89 PIK3CA (0.59) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1192769 0.83 PIK3CA (0.64) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1192255 0.82 PIK3CA (0.56) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1192331 0.82 PIK3CA (0.61) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1191889 0.81 MTOR (0.73) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1311666 0.80 PIK3CA (0.56) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1311868 0.80 PIK3CA (0.73) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1192759 0.79 PIK3CA (0.68) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL1310504 0.79 PIK3CA (0.62) MTORPIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL4440763 0.77 MTOR (0.81) MTORPIK3CAPIK3CBPIK3CDPIK3CG

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 MTOR 1/4885PIK3CA 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.