⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14775405 | 1.00 | — | — | |
| SCHEMBL1598830 | 0.87 | ALDH1A1 (0.38) | — | |
| SCHEMBL153167 | 0.87 | ALDH1A1 (0.38) | — | |
| SCHEMBL10583137 | 0.83 | ALDH1A1 (0.35) | — | |
| SCHEMBL14775393 | 0.79 | — | — | |
| SCHEMBL28094579 | 0.79 | ALDH1A1 (0.52) | — | |
| SCHEMBL6958516 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL14775395 | 0.79 | — | — | |
| SCHEMBL6416034 | 0.79 | HCAR2 (0.40) | — | |
| SCHEMBL11122755 | 0.79 | F7 (0.41) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110156741-B | Method for synthesizing carbonic acid butylene ester | 中国科学院过程工程研究所 | 2021-02-26 | — | — | CN | disclosed |
| CN-211785081-U | Photoelastic coefficient measuring instrument for optical resin material | 中国科学技术大学 | 2020-10-27 | — | — | CN | disclosed |
| CN-111157458-A | Photoelastic coefficient measuring instrument for optical resin material | 中国科学技术大学 | 2020-05-15 | — | — | CN | disclosed |
| EP-2571090-B9 | NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEM CORP (JP) | 2017-03-15 | — | — | EP | disclosed |
| EP-2571090-B1 | NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEM CORP (JP) | 2016-09-07 | — | — | EP | disclosed |
| US-20150044554-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2015-02-12 | — | — | US | disclosed |
| US-20130071731-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2013-03-21 | — | — | US | disclosed |
| US-20130071730-A1 | NONAQUEOUS ELECTROLYTE SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2013-03-21 | — | — | US | disclosed |
| EP-2571090-A1 | NONAQUEOUS-ELECTROLYTE SECONDARY BATTERY | Mitsubishi Chemical Corporation (JP) | 2013-03-20 | — | — | EP | disclosed |
| EP-2571089-A1 | NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY | Mitsubishi Chemical Corporation (JP) | 2013-03-20 | — | — | EP | disclosed |