SCHEMBL1136790

SCHEMBL1136790

Nc1nc(N)c(C(=O)O)nc1Cl.[LiH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCNN1A P37088 11/20 0.56
▸ ALDH1A1 P00352 7/20 0.56
▸ KDM4E B2RXH2 6/20 0.56
▸ HPGD P15428 6/20 0.56
▸ HSD17B10 Q99714 6/20 0.56
▸ GLA P06280 5/20 0.56
▸ CYP1A2 P05177 4/20 0.56
▸ GAA P10253 3/20 0.56
▸ LMNA P02545 3/20 0.56
▸ CYP2D6 P10635 3/20 0.56
▸ PLAU P00749 2/20 0.56
▸ FTO Q9C0B1 2/20 0.56
▸ BLM P54132 2/20 0.56
▸ SLC22A1 O15245 1/20 0.56
▸ HTR1A P08908 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ SLC9A1 P19634 1/20 0.56
▸ MAOA P21397 1/20 0.56
▸ ADORA2A P29274 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56

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
SCHEMBL31647638 0.98 SCNN1A (0.58) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1134621 0.98 SCNN1A (0.58) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL29768708 0.86 TDP1 (0.57) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL3793535 0.86 TDP1 (0.57) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2518975 0.81 TDP1 (0.43) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23337629 0.80 SCNN1A (0.58) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL31325583 0.80 SCNN1A (0.63) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL805324 0.80 SCNN1A (0.63) SCNN1AALDH1A1KDM4EHPGDHSD17B10
Water SCHEMBL11775578 0.79 TDP1 (0.41) SCNN1AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL2492971 0.78 SCNN1A (0.56) SCNN1AALDH1A1KDM4EHPGDHSD17B10

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2444120-B1 Spirocyclic amiloride analogues as ENac blockers NOVARTIS AG (CH) 2017-09-27 — — EP disclosed
US-9643983-B2 Treating diseases mediated by blockade of the epithelial sodium channel with pyrazine-2-carboxamide derivatives NOVARTIS AG (CH) 2017-05-09 — — US disclosed
EP-2231280-B1 Amiloride-like Pyrazine-carboxamides as ENaC blockers NOVARTIS AG (CH) 2016-08-10 — — EP disclosed
US-20160068546-A1 TREATING DISEASES MEDIATED BY BLOCKADE OF THE EPITHELIAL SODIUM CHANNEL WITH PYRAZINE-2-CARBOXAMIDE DERIVATIVES NOVARTIS AG (CH) 2016-03-10 — — US disclosed
US-9139586-B2 Treating diseases mediated by blockade of the epithelial sodium channel with pyrazine-2-carboxamide derivatives NOVARTIS AG (CH) 2015-09-22 — — US disclosed
US-20150231142-A1 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases VERTEX PHARMA (US) 2015-08-20 — — US disclosed
US-20150150879-A2 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases VERTEX PHARMACEUTICALS INCORPORATED 2015-06-04 — — US disclosed
EP-2813227-A1 Compositions for treatment of cystic fibrosis and other chronic diseases Vertex Pharmaceuticals Incorporated (US) 2014-12-17 — — EP disclosed
US-20140329814-A2 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases VERTEX PHARMA (US) 2014-11-06 — — US disclosed
US-20140171421-A1 TREATING DISEASES MEDIATED BY BLOCKADE OF THE EPITHELIAL SODIUM CHANNEL WITH PYRAZINE-2-CARBOXAMIDE DERIVATIVES NOVARTIS AG (CH) 2014-06-19 — — US disclosed
EP-2332933-A1 Epithelial sodium channel (ENaC) inhibitors Novartis AG (CH) 2011-06-15 — — EP disclosed
WO-2011050325-A1 COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS AND OTHER CHRONIC DISEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-04-28 — — WO disclosed
US-20110098311-A1 COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS AND OTHER CHRONIC DISEASES Vertex Pharmaceuticals Incorported (US) 2011-04-28 — — US disclosed
EP-2155721-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-23 — — EP disclosed
EP-2231280-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2010-09-29 — — EP disclosed
US-20100130506-A1 Organic Compounds NOVARTIS AG 2010-05-27 — — US disclosed
US-20100105660-A1 ORGANIC COMPOUNDS75074 NOVARTIS AG (CH) 2010-04-29 — — US disclosed
EP-2155721-A1 ORGANIC COMPOUNDS Novartis Ag (CH) 2010-02-24 — — EP disclosed
WO-2009074575-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-06-18 — — WO disclosed
WO-2008135557-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-11-13 — — 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 (8 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-20110098311-A1 COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS AND OTHER CHRONIC DISEASES CFTR, SLC26A4, ABCB11 SCNN1A 16/4885ALDH1A1 2535/4885KDM4E 4481/4885
US-20140329814-A2 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases CFTR, SLC26A4, ABCB11 SCNN1A 16/4885ALDH1A1 2535/4885KDM4E 4481/4885
US-20100105660-A1 ORGANIC COMPOUNDS75074 SCNN1A, TRPM4, TRPV4 SCNN1A 1/4885ALDH1A1 1031/4885KDM4E 4520/4885
US-20160068546-A1 TREATING DISEASES MEDIATED BY BLOCKADE OF THE EPITHELIAL SODIUM CHANNEL WITH PYRAZINE-2-CARBOXAMIDE DERIVATIVES SCNN1B, SCNN1A, SCNN1G SCNN1A 2/4885ALDH1A1 2199/4885KDM4E 2621/4885
US-20150231142-A1 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases CFTR, SLC26A4, ABCB11 SCNN1A 16/4885ALDH1A1 2535/4885KDM4E 4481/4885
US-20100130506-A1 Organic Compounds OR10J3, REN, CACNA1E SCNN1A 29/4885ALDH1A1 1317/4885KDM4E 2779/4885
US-20150150879-A2 Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases CFTR, SLC26A4, ABCB11 SCNN1A 16/4885ALDH1A1 2535/4885KDM4E 4481/4885
US-20140171421-A1 TREATING DISEASES MEDIATED BY BLOCKADE OF THE EPITHELIAL SODIUM CHANNEL WITH PYRAZINE-2-CARBOXAMIDE DERIVATIVES SCNN1B, SCNN1A, SCNN1G SCNN1A 2/4885ALDH1A1 2199/4885KDM4E 2621/4885

“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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