SCHEMBL14312329

SCHEMBL14312329

C=CCN(CC=C)c1nc(OCC(=C)C)nc(OCC(=C)C)n1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 2/20 0.33
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.30

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
SCHEMBL14312280 0.97 POLB (0.34) CRHR1POLBHTT
SCHEMBL14312193 0.90 POLB (0.33) CRHR1POLBHTT
SCHEMBL14312176 0.86 POLB (0.33) POLBHTT
SCHEMBL14312194 0.85 GAA (0.41) CRHR1HTT
SCHEMBL14312308 0.83 POLB (0.36) POLBHTT
SCHEMBL2487338 0.78 CDK1 (0.39) POLBHTT
SCHEMBL14312253 0.78 MAPT (0.42) CRHR1
SCHEMBL14312160 0.74 MAPT (0.42) CRHR1
SCHEMBL14312266 0.73 GAA (0.40) POLBHTT
SCHEMBL14236814 0.72 ALDH1A1 (0.41) CRHR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987383-B2 Triazine derivatives and application thereof NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2015-03-24 — — US disclosed
US-20130023629-A1 TRIAZINE DERIVATIVES AND APPLICATION THEREOF SHINRYO CORPORATION (JP) 2013-01-24 — — US disclosed
EP-2537833-A1 TRIAZINE DERIVATIVE, AND APPLICATION THEREOF Nippon Kasei Chemical Company Limited (JP) 2012-12-26 — — EP 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-20130023629-A1 TRIAZINE DERIVATIVES AND APPLICATION THEREOF HSPH1, PRDX3, PRXL2A CRHR1 658/4885POLB 2133/4885HTT 2457/4885

“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.

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