⚠ 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 | |
|---|---|---|---|---|
| Isopropyl Isothiocyanate SCHEMBL20183963 | 0.80 | TRPA1 (0.56) | — | |
| SCHEMBL78328 | 0.77 | — | — | |
| SCHEMBL31414859 | 0.77 | — | — | |
| SCHEMBL20677460 | 0.69 | TRPA1 (0.38) | — | |
| SCHEMBL5307033 | 0.69 | — | — | |
| SCHEMBL2759885 | 0.67 | — | — | |
| SCHEMBL4408197 | 0.66 | — | — | |
| SCHEMBL1567359 | 0.65 | MAPT (0.42) | — | |
| Ammonia Solution, Strong SCHEMBL2484130 | 0.64 | — | — | |
| SCHEMBL23070416 | 0.64 | MIF (0.57) | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11891472-B2 | Composition, production method for composition, and production method for unsaturated compound | RESONAC CORPORATION (JP) | 2024-02-06 | — | — | US | disclosed |
| EP-3842417-B1 | COMPOSITION, PRODUCTION METHOD FOR COMPOSITION, AND PRODUCTION METHOD FOR UNSATURATED COMPOUND | RESONAC CORP (JP) | 2024-01-24 | — | — | EP | disclosed |
| CN-116583498-A | Blocked isocyanate compound | 株式会社力森诺科 | 2023-08-11 | — | — | CN | disclosed |
| US-11661474-B2 | Composition, production method for composition, and production method for unsaturated compound | SHOWA DENKO K.K. (JP) | 2023-05-30 | — | — | US | disclosed |
| EP-3842414-B1 | COMPOSITION, PRODUCTION METHOD FOR COMPOSITION, AND PRODUCTION METHOD FOR UNSATURATED COMPOUND | SHOWA DENKO KK (JP) | 2023-04-05 | — | — | EP | disclosed |
| CN-112533896-B | Composition, method for producing composition, and method for producing unsaturated compound | 昭和电工株式会社 | 2023-03-03 | — | — | CN | disclosed |
| EP-3842416-B1 | COMPOSITION, PRODUCTION METHOD FOR COMPOSITION, AND PRODUCTION METHOD FOR UNSATURATED COMPOUND | SHOWA DENKO KK (JP) | 2023-03-01 | — | — | EP | disclosed |
| CN-112533895-B | Composition, method for producing composition, and method for producing unsaturated compound | 昭和电工株式会社 | 2023-02-17 | — | — | CN | disclosed |
| CN-114929668-A | (meth) acrylate compound having isocyanate group and method for producing same | 昭和电工株式会社 | 2022-08-19 | — | — | CN | disclosed |
| US-20220119585-A1 | COMPOSITION, PRODUCTION METHOD FOR COMPOSITION, AND PRODUCTION METHOD FOR UNSATURATED COMPOUND | SHOWA DENKO K.K. (JP) | 2022-04-21 | — | — | US | disclosed |
| EP-2676951-A1 | STABILIZED ISOCYANATE GROUP-CONTAINING ETHYLENE-BASED UNSATURATED COMPOUND | SHOWA DENKO K.K. (JP) | 2013-12-25 | — | — | EP | disclosed |
| EP-2676950-A1 | STABILIZED ISOCYANATE GROUP-CONTAINING ETHYLENE-BASED UNSATURATED COMPOUND | SHOWA DENKO K.K. (JP) | 2013-12-25 | — | — | EP | disclosed |
| US-20130317248-A1 | STABILIZED ISOCYANATE GROUP-CONTAINING ETHYLENICALLY UNSATURATED COMPOUND | SHOWA DENKO K.K. (JP) | 2013-11-28 | — | — | US | disclosed |
| US-20130317252-A1 | STABILIZED ISOCYANATE GROUP-CONTAINING ETHYLENICALLY UNSATURATED COMPOUND | SHOWA DENKO K.K. (JP) | 2013-11-28 | — | — | US | disclosed |
| US-20120205234-A1 | POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION | SHOWA DENKO K.K. (JP) | 2012-08-16 | — | — | US | disclosed |
| US-20110137066-A1 | PROCESS OF INHIBITING POLYMERIZATION OF ISOCYANATE GROUP-CONTAINING, ETHYLENICALLY UNSATURATED CARBOXYLATE COMPOUNDS, AND PROCESS FOR PRODUCING THE COMPOUNDS | SHOWA DENKO K.K. (JP) | 2011-06-09 | — | — | US | disclosed |
| EP-2325166-A1 | METHOD FOR INHIBITING POLYMERIZATION OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACID ESTER COMPOUND CONTAINING ISOCYANATE GROUP AND METHOD FOR PRODUCING ETHYLENICALLY UNSATURATED CARBOXYLIC ACID ESTER COMPOUND CONTAINING ISOCYANATE GROUP | Showa Denko K.K. (JP) | 2011-05-25 | — | — | EP | disclosed |
| US-20100099827-A1 | POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION | SHOWA DENKO K.K. (JP) | 2010-04-22 | — | — | US | disclosed |
| EP-2091994-A1 | POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION | Showa Denko K.K. (JP) | 2009-08-26 | — | — | EP | disclosed |
| WO-2008069256-A1 | POLYMERIZABLE MONOMER COMPOSITION AND METHOD FOR PREVENTING POLYMERIZATION | SHOWA DENKO K.K. (JP) | 2008-06-12 | — | — | WO | disclosed |