⚠ 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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL368167 | 1.00 | ALDH1A1 (0.44) | — | |
| Acetonitrile SCHEMBL169615 | 1.00 | ALDH1A1 (0.44) | — | |
| Acetonitrile SCHEMBL15232266 | 1.00 | ALDH1A1 (0.44) | — | |
| Methyl Alcohol SCHEMBL16240074 | 0.90 | ALDH1A1 (0.47) | — | |
| Methyl Alcohol SCHEMBL7165044 | 0.90 | — | — | |
| Water SCHEMBL2192190 | 0.89 | — | — | |
| SCHEMBL25008 | 0.89 | — | — | |
| SCHEMBL30498455 | 0.89 | — | — | |
| SCHEMBL29172255 | 0.86 | — | — | |
| SCHEMBL28283743 | 0.86 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2626374-B1 | DIENE-BASED CARBOXYLATE ANION AND SALT THEREOF, AND POLYMERIZABLE OR CURABLE COMPOSITION THEREOF | NIPPON CATALYTIC CHEM IND (JP) | 2019-05-15 | — | — | EP | disclosed |
| US-9499466-B2 | Diene-based carboxylate anion and salt thereof, and polymerizable or curable composition thereof | NIPPON SHOKUBAI CO., LTD. (JP) | 2016-11-22 | — | — | US | disclosed |
| CN-103154052-B | Diene carboxylate anion, salt thereof, and polymerization or curing composition thereof | NIPPON SHOKUBAI CO.,LTD. (JP) | 2016-02-24 | — | — | CN | disclosed |
| CN-102365260-B | a-(unsaturated alkoxyalkyl)acrylate composition and process for production thereof | NIPPON CATALYTIC CHEM IND | 2015-04-15 | — | — | CN | disclosed |
| EP-2415751-B1 | ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF | NIPPON CATALYTIC CHEM IND (JP) | 2014-11-26 | — | — | EP | disclosed |
| US-8796492-B2 | α-(unsaturated alkoxyalkyl) acrylate composition and process for production thereof | NIPPON SHOKUBAI CO., LTD. (JP) | 2014-08-05 | — | — | US | disclosed |
| EP-2626374-A1 | DIENE-BASED CARBOXYLATE ANION AND SALT THEREOF, AND POLYMERIZABLE OR CURABLE COMPOSITION THEREOF | Nippon Shokubai Co., Ltd. (JP) | 2013-08-14 | — | — | EP | disclosed |
| US-20130197123-A1 | DIENE-BASED CARBOXYLATE ANION AND SALT THEREOF, AND POLYMERIZABLE OR CURABLE COMPOSITION THEREOF | NIPPON SHOKUBAI CO., LTD. (JP) | 2013-08-01 | — | — | US | disclosed |
| CN-103154052-A | Diene carboxylate anion, salt thereof, and polymerization or curing composition thereof | NIPPON CATALYTIC CHEM IND | 2013-06-12 | — | — | CN | disclosed |
| CN-102365260-A | a-(unsaturated alkoxyalkyl)acrylate composition and process for production thereof | NIPPON CATALYTIC CHEM IND | 2012-02-29 | — | — | CN | disclosed |
| EP-2415751-A1 | ALPHA-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF | Nippon Shokubai Co., Ltd. (JP) | 2012-02-08 | — | — | EP | disclosed |
| US-20120016095-A1 | a-(UNSATURATED ALKOXYALKYL) ACRYLATE COMPOSITION AND PROCESS FOR PRODUCTION THEREOF | NIPPON SHOKUBAI CO., LTD. (JP) | 2012-01-19 | — | — | US | disclosed |
| US-20110028715-A1 | NOVEL ADENINE COMPOUND | DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) | 2011-02-03 | — | — | US | disclosed |
| US-20100093998-A1 | NOVEL ADENINE COMPOUND | DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) | 2010-04-15 | — | — | US | disclosed |
| CN-101679433-A | Novel adenine compound | DAINIPPON SUMITOMO PHARMA CO | 2010-03-24 | — | — | CN | disclosed |
| US-4053526-A | PROCESS FOR ISOLATING DINITRONAPHTHALENES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-11 | — | — | US | disclosed |