SCHEMBL16453260

SCHEMBL16453260

COc1ccc(CCC[N+](C)(CCCc2ccc(OC)cc2)CC(C)(C)NC(=O)c2nc(Cl)c(N)nc2N)cc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCNN1A P37088 13/20 0.58
▸ KCNH2 Q12809 2/20 0.44

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
Hydrochloric Acid SCHEMBL20677525 0.99 SCNN1A (0.57) SCNN1AKCNH2
SCHEMBL11959320 0.84 SCNN1A (0.60) SCNN1AKCNH2
SCHEMBL16453262 0.81 SCNN1A (0.58) SCNN1AKCNH2
SCHEMBL20683754 0.81 SCNN1A (0.58) SCNN1AKCNH2
SCHEMBL11959327 0.81 KCNH2 (0.63) SCNN1AKCNH2
Hydrochloric Acid SCHEMBL20677537 0.81 SCNN1A (0.57) SCNN1AKCNH2
Hydrochloric Acid SCHEMBL20677538 0.81 SCNN1A (0.57) SCNN1AKCNH2
Trifluoroacetic Acid SCHEMBL1428997 0.80 SCNN1A (0.54) SCNN1AKCNH2
Bromide SCHEMBL1428354 0.80 KCNH2 (0.64) SCNN1AKCNH2
SCHEMBL11959318 0.79 SCNN1A (0.61) SCNN1AKCNH2

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-3030555-B1 NOVEL PYRAZINE AMIDE COMPOUNDS BOEHRINGER INGELHEIM INT (DE) 2019-01-30 — — EP disclosed
US-9096548-B2 Pyrazine amide compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-08-04 — — US disclosed
US-20150045326-A1 NOVEL PYRAZINE AMIDE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-02-12 — — US disclosed
WO-2015018754-A1 NOVEL PYRAZINE AMIDE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-02-12 — — 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-20150045326-A1 NOVEL PYRAZINE AMIDE COMPOUNDS HRH4, HRH1, HRH2 SCNN1A 285/4885KCNH2 221/4885

“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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