⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1576988 | 0.64 | — | — | |
| SCHEMBL12062681 | 0.50 | — | — | |
| SCHEMBL100842 | 0.46 | — | — | |
| SCHEMBL30149517 | 0.30 | — | — | |
| SCHEMBL29006319 | 0.30 | — | — | |
| SCHEMBL29393826 | 0.30 | — | — | |
| SCHEMBL22449479 | 0.30 | — | — | |
| SCHEMBL156040 | 0.30 | — | — | |
| SCHEMBL27698505 | 0.30 | — | — | |
| SCHEMBL28148575 | 0.30 | — | — |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020225088-A1 | METHOD FOR THE PURIFICATION OF ISOCYANATES | COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) | 2020-11-12 | — | — | WO | disclosed |
| EP-3652232-A1 | INORGANIC TIN COMPOUNDS AND USE THEREOF | Covestro Deutschland AG (DE) | 2020-05-20 | — | — | EP | disclosed |
| EP-3601405-A1 | FORMATION OF COATINGS BY SEPARATE APPLICATION OF POLYISOCYANATE COMPOSITIONS AND CROSSLINKING CATALYSTS | Covestro Deutschland AG (DE) | 2020-02-05 | — | — | EP | disclosed |
| WO-2019011957-A1 | INORGANIC TIN COMPOUNDS AND USE THEREOF | COVESTRO DEUTSCHLAND AG (DE) | 2019-01-17 | — | — | WO | disclosed |
| WO-2018178149-A1 | FORMATION OF COATINGS BY SEPARATE APPLICATION OF POLYISOCYANATE COMPOSITIONS AND CROSSLINKING CATALYSTS | COVESTRO DEUTSCHLAND AG (DE) | 2018-10-04 | — | — | WO | disclosed |
| EP-3155031-A1 | POLYISOCYANATES HAVING THIOALLOPHANATE STRUCTURE | Covestro Deutschland AG (DE) | 2017-04-19 | — | — | EP | disclosed |
| EP-3129353-A1 | COMPOSITION FOR PRODUCING TRANSPARENT POLYTHIOURETHANE BODIES | Covestro Deutschland AG (DE) | 2017-02-15 | — | — | EP | disclosed |
| EP-3129352-A1 | COMPOSITION CONTAINING AROMATIC NITRILES FOR THE PRODUCTION OF TRANSPARENT POLYTHIOURETHANE BODIES | Covestro Deutschland AG (DE) | 2017-02-15 | — | — | EP | disclosed |
| WO-2015189169-A1 | POLYISOCYANATES HAVING THIOALLOPHANATE STRUCTURE | COVESTRO DEUTSCHLAND AG (DE) | 2015-12-17 | — | — | WO | disclosed |
| WO-2015155367-A1 | COMPOSITION CONTAINING AROMATIC NITRILES FOR THE PRODUCTION OF TRANSPARENT POLYTHIOURETHANE BODIES | BAYER MATERIALSCIENCE AG (DE) | 2015-10-15 | — | — | WO | disclosed |
| EP-2596040-A1 | POLYURETHANE HAVING LOW VOLUME SHRINKAGE | Bayer Intellectual Property GmbH (DE) | 2013-05-29 | — | — | EP | disclosed |
| EP-2596042-A1 | POLYISOCYANATE MIXTURES | Bayer Intellectual Property GmbH (DE) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012010524-A1 | POLYURETHANE HAVING LOW VOLUME SHRINKAGE | BAYER MATERIALSCIENCE AG (DE) | 2012-01-26 | — | — | WO | disclosed |
| WO-2012010523-A1 | POLYISOCYANATE MIXTURES | BAYER MATERIALSCIENCE AG (DE) | 2012-01-26 | — | — | WO | disclosed |
| EP-2389405-A1 | POLYURETHANE CASTING COMPOUNDS | Bayer MaterialScience AG (DE) | 2011-11-30 | — | — | EP | disclosed |
| EP-2389403-A1 | POLYURETHANE SEALING COMPOUNDS | Bayer MaterialScience AG (DE) | 2011-11-30 | — | — | EP | disclosed |
| US-20110257454-A1 | Use of an Additive in the Coupling of Toluene with a Carbon Source | FINA TECHNOLOGY, INC. (US) | 2011-10-20 | — | — | US | disclosed |
| US-20110255211-A1 | HIGHLY DIELECTRIC FILM | DAIKIN INDUSTRIES, LTD. (JP) | 2011-10-20 | — | — | US | disclosed |
| WO-2010083957-A1 | POLYURETHANE SEALING COMPOUNDS | BAYER MATERIALSCIENCE AG (DE) | 2010-07-29 | — | — | WO | disclosed |
| WO-2010083958-A1 | POLYURETHANE CASTING COMPOUNDS | BAYER MATERIALSCIENCE AG (DE) | 2010-07-29 | — | — | WO | disclosed |