Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Potassium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9323175 | 0.92 | ALDH1A1 (0.50) | — | |
| SCHEMBL10458537 | 0.92 | ALDH1A1 (0.50) | — | |
| Lithium Ion SCHEMBL3855722 | 0.92 | — | — | |
| SCHEMBL8167789 | 0.92 | ALDH1A1 (0.50) | — | |
| SCHEMBL3860699 | 0.92 | ALDH1A1 (0.50) | — | |
| SCHEMBL5014719 | 0.92 | ALDH1A1 (0.50) | — | |
| SCHEMBL9322302 | 0.92 | ALDH1A1 (0.50) | — | |
| SCHEMBL3133203 | 0.92 | ALDH1A1 (0.50) | — | |
| Silver SCHEMBL8940458 | 0.92 | — | — | |
| SCHEMBL10458639 | 0.92 | ALDH1A1 (0.50) | — |
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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1522547-B1 | Highly reactive liquid uretdione groups-containing polyurethane systems which are curable at low temperature | EVONIK DEGUSSA GMBH (DE) | 2009-09-30 | — | — | EP | claimed |
| WO-2009068377-A1 | POLYURETHANE COMPOUNDS CONTAINING URETDIONE GROUPS AND HARDENABLE AT LOW TEMPERATURE AND ALSO CONTAINING ADHESION-IMPROVING RESINS | EVONIK DEGUSSA GMBH (DE) | 2009-06-04 | — | — | WO | claimed |
| EP-1844084-A1 | HIGHLY REACTIVE URETDIONE GROUP-CONTAINING POLYURETHANE COMPOSITIONS BASED ON 1,4-DIISOCYANATO-DICYCLOHEXYL METHANE | Degussa GmbH (DE) | 2007-10-17 | — | — | EP | claimed |
| EP-1799744-A1 | HIGHLY REACTIVE POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS | Degussa AG (DE) | 2007-06-27 | — | — | EP | claimed |
| WO-2006069839-A1 | HIGHLY REACTIVE URETDIONE GROUP-CONTAINING POLYURETHANE COMPOSITIONS BASED ON 1,4-DIISOCYANATO-DICYCLOHEXYL METHANE | DEGUSSA GMBH (DE) | 2006-07-06 | — | — | WO | claimed |
| WO-2006040225-A1 | HIGHLY REACTIVE POLYURETHANE COMPOSITIONS CONTAINING URETDIONE GROUPS | DEGUSSA AG (DE) | 2006-04-20 | — | — | WO | claimed |
| EP-1522548-A1 | Uretdione-group-containing polyurethane compositions which are cross-linkable at low temperatures | Degussa AG (DE) | 2005-04-13 | — | — | EP | claimed |
| EP-1522547-A1 | Highly reactive liquid uretdione groups-containing polyurethane systems which are curable at low temperature | Degussa AG (DE) | 2005-04-13 | — | — | EP | claimed |
| EP-1475400-A1 | Solid uretdione groups containing polyurethane powder coatings compositions curable at low temperature | Degussa AG (DE) | 2004-11-10 | — | — | EP | claimed |
| EP-2297104-B1 | 2-ALKOXY-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | BAYER IP GMBH (DE) | 2013-08-07 | — | — | EP | disclosed |
| EP-2297104-A1 | 2-ALKOXY-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | Bayer Schering Pharma Aktiengesellschaft (DE) | 2011-03-23 | — | — | EP | disclosed |
| EP-1658266-B1 | PENTAFLUOROSULFANYL PHENYL-SUBSTITUTED BENZOYLGUANIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE AS MEDICAMENTS OR DIAGNOSTIC AGENTS AND MEDICAMENT CONTAINING SAID COMPOUNDS | SANOFI AVENTIS DEUTSCHLAND (DE) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009143992-A1 | 2-ALKOXY-SUBSTITUTED DICYANOPYRIDINES AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-12-03 | — | — | WO | disclosed |
| EP-1522547-B1 | Highly reactive liquid uretdione groups-containing polyurethane systems which are curable at low temperature | EVONIK DEGUSSA GMBH (DE) | 2009-09-30 | — | — | EP | disclosed |
| EP-1181264-A1 | METHOD FOR PRODUCING 2,2,4,4-TETRA-SUBSTITUTED 1,3,5-CYCLOHEXANETRIONES | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-27 | — | — | EP | disclosed |
| WO-2001060776-A1 | METHOD FOR SYNTHESIZING 2,2,4,4-TETRASUBSTITUTED 1,3,5-CYCLOHEXANE TRIONS | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-23 | — | — | WO | disclosed |
| WO-2001017954-A1 | BILE ACID-SUBSTITUTED PHENYL-ALKENOYLGUANIDINES, METHOD FOR PRODUCING SAID PHENYL-ALKENOYLGUANIDINES, USE THEREOF AS MEDICAMENTS OR DIAGNOSTIC REAGENTS AND MEDICAMENTS CONTAINING THE SAME | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2001-03-15 | — | — | WO | disclosed |
| WO-2000075095-A1 | METHOD FOR PRODUCING 2,2,4,4-TETRA-SUBSTITUTED 1,3,5-CYCLOHEXANETRIONES | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-14 | — | — | WO | disclosed |
| US-4126428-A | MINUTE CAPSULES HAVING PERMEABLE PARTIALLY POLYMERIZED ISOCYANATE WALLS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1978-11-21 | — | — | US | disclosed |
| US-3963680-A | CURING CATALYSTS, POLYFUNCTIONAL AMINE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1976-06-15 | — | — | US | disclosed |