SCHEMBL1311534

SCHEMBL1311534

Cc1nccn1-c1nccc(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)n1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 14/20 0.61
MTOR P42345 12/20 0.61
EIF2AK2 P19525 1/20 0.47
PIK3R1 P27986 8/20 0.46
PIK3CB P42338 3/20 0.46
PIK3CD O00329 2/20 0.46
FLT3 P36888 1/20 0.45
PIK3CG P48736 1/20 0.44
NPSR1 Q6W5P4 1/20 0.42
CCNT1 O60563 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK9 P50750 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
SCHEMBL1309279 0.84 PIK3CA (0.61) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL1308989 0.83 PIK3CA (0.61) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL1311581 0.81 PIK3CA (0.56) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL1309314 0.80 PIK3CA (0.57) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL18117986 0.80 PIK3CA (0.57) PIK3CAMTORPIK3R1PIK3CBPIK3CD
SCHEMBL1310118 0.80 PIK3CA (0.53) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL7920246 0.80 PIK3CA (0.46) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL1310161 0.80 EIF2AK2 (0.47) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL1309070 0.79 PIK3CA (0.56) PIK3CAMTOREIF2AK2PIK3R1PIK3CB
SCHEMBL1310989 0.79 PIK3CA (0.56) PIK3CAMTORPIK3R1PIK3CBPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2364302-B1 TRIAZINE ANALOGS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES UNIV BASEL (CH) 2016-10-05 EP 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-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 PIK3CA 2/4885MTOR 1/4885EIF2AK2 869/4885

“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.