SCHEMBL1724563

SCHEMBL1724563

CCC(NS(C)(=O)=O)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.34
CA2 P00918 4/20 0.33
CA1 P00915 4/20 0.33
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.31
CA12 O43570 3/20 0.31
CA9 Q16790 3/20 0.31
CA14 Q9ULX7 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 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
SCHEMBL12069014 1.00 SCN9A (0.34) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL12071190 1.00 SCN9A (0.34) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL16478583 0.84 USP2 (0.33) CA2CA1ITGB3ITGA2BUSP2
SCHEMBL21389077 0.83 CA1 (0.35) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL21389092 0.83 CA1 (0.35) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL157579 0.83 CA1 (0.33) CA2CA1CA12CA9CA14
SCHEMBL7357154 0.81 ECE1 (0.40) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL7357150 0.81 ECE1 (0.40) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL16886886 0.81 ECE1 (0.40) SCN9ACA2CA1ITGB3ITGA2B
SCHEMBL24108521 0.80 ITGB3 (0.39) ITGB3ITGA2BUSP2TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4531566-A1 AZOLE FUNGICIDE COMPOSITION ADAMA MAKHTESHIM LTD. (IL) 2025-04-09 EP disclosed
WO-2023233378-A1 AZOLE FUNGICIDE COMPOSITION ADAMA MAKHTESHIM LTD. (IL) 2023-12-07 WO disclosed
EP-4255190-A1 COPPER-BASED FUNGICIDE COMPOSITION ADAMA MAKHTESHIM LTD. (IL) 2023-10-11 EP disclosed
WO-2022118255-A1 COPPER-BASED FUNGICIDE COMPOSITION ADAMA MAKHTESHIM LTD. (IL) 2022-06-09 WO disclosed
WO-2020226482-A1 SYNERGISTIC COMPOSITIONS FOR CONTROLLING PLANT PATHOGENS WITH CHITINOLYTIC MICROORGANISMS / ORGANIC ACID COMBINATIONS AND METHOD OF USE THEREOF LAI HONG HENG (MY) 2020-11-12 WO disclosed
US-20160326111-A1 ARYL SUBSTITUTED INDOLES AND THE USE THEREOF PURDUE PHARMA LP (US) 2016-11-10 US disclosed
US-9212139-B2 Aryl substituted indoles and their use as blockers of sodium channels PURDUE PHARMA, L.P. (US) 2015-12-15 US disclosed
EP-2809157-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. Du Pont de Nemours and Company (US) 2014-12-10 EP disclosed
EP-2582666-B1 ARYL SUBSTITUTED INDOLES AND THEIR USE AS BLOCKERS OF SODIUM CHANNELS PURDUE PHARMA LP (US) 2014-08-13 EP disclosed
US-20130296281-A1 Aryl Substituted Indoles and Their Use as Blockers of Sodium Channels PURDUE PHARMA L.P. (US) 2013-11-07 US disclosed
WO-2013116251-A2 FUNGICIDAL PYRAZOLE MIXTURES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-08-08 WO disclosed
EP-1667525-B1 CONCENTRATED SUSPENSIONS BAYER CROPSCIENCE AG (DE) 2012-12-19 EP disclosed
CN-101006056-B 3' -alkoxy spirocyclic tetramic and tetronic acids BAYER CROPSCIENCE AG 2012-07-25 CN disclosed
EP-2403834-A1 Fungicidal pyrazoles E. I. du Pont de Nemours and Company (US) 2012-01-11 EP disclosed
WO-2011158108-A2 ARYL SUBSTITUTED INDOLES AND THE USE THEREOF PURDUE PHARMA L.P. (US) 2011-12-22 WO disclosed
WO-2010101973-A1 FUNGICIDAL PYRAZOLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-09-10 WO disclosed
CN-101495448-A alkoxyalkyl-substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2009-07-29 CN disclosed
EP-1558592-A1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES Bayer CropScience Aktiengesellschaft (DE) 2005-08-03 EP disclosed
WO-2004039789-A1 THIAZOL-(BI)CYCLOALKYL-CARBOXANILIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-05-13 WO disclosed
EP-0259092-A1 Substituted hexahydroarylquinolizines MERCK & CO. INC. (US) 1988-03-09 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 (2 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-20130296281-A1 Aryl Substituted Indoles and Their Use as Blockers of Sodium Channels SCN5A, TRPV1, TRPV5 SCN9A 75/4885CA2 342/4885CA1 1691/4885
US-20160326111-A1 ARYL SUBSTITUTED INDOLES AND THE USE THEREOF TRPC5, TRPV5, TRPV1 SCN9A 110/4885CA2 382/4885CA1 1362/4885

“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.