⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10881607 | 0.78 | — | — | |
| SCHEMBL19974061 | 0.78 | — | — | |
| SCHEMBL29131107 | 0.74 | — | — | |
| SCHEMBL8970857 | 0.74 | — | — | |
| SCHEMBL11256057 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL19395650 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL1557202 | 0.72 | ALDH1A1 (0.40) | — | |
| SCHEMBL19395851 | 0.72 | — | — | |
| SCHEMBL19395933 | 0.72 | — | — | |
| SCHEMBL1561829 | 0.72 | THRB (0.36) | — |
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-111393473-A | Preparation method of ethyl methyl ethyl phosphinate | 利尔化学股份有限公司 | 2020-07-10 | — | — | CN | claimed |
| CN-116947918-A | Dialkyl phosphinic acid hybrid salt and preparation method and application thereof | 中国科学院宁波材料技术与工程研究所 | 2023-10-27 | — | — | CN | disclosed |
| WO-2023201541-A1 | HYBRIDIZED DIALKYL PHOSPHINATE SALT, METHOD FOR PREPARING SAME, AND USE THEREOF | 中国科学院宁波材料技术与工程研究所 | 2023-10-26 | — | — | WO | disclosed |
| CN-111393473-A | Preparation method of ethyl methyl ethyl phosphinate | 利尔化学股份有限公司 | 2020-07-10 | — | — | CN | disclosed |
| CN-111048841-A | Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2020-04-21 | — | — | CN | disclosed |
| CN-104163831-A | Methylethyl hypophosphite, and preparation method and application thereof | LISIDE NEW MATERIAL CO LTD | 2014-11-26 | — | — | CN | disclosed |
| EP-1773740-B1 | NEUROLOGICALLY-ACTIVE COMPOUNDS | UNIV SYDNEY (AU) | 2009-02-18 | — | — | EP | disclosed |
| US-20080032950-A1 | Neurologically-Active Compounds | THE UNIVERSITY OF SYDNEY (AU) | 2008-02-07 | — | — | US | disclosed |
| US-4401473-A | Use of dimethylphosphinylalkanephosphonic acid as a setting retarder in gypsum | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-08-30 | — | — | US | disclosed |
| US-4069247-A | Preparation of phosphonic and/or phosphinic acids | HOECHST AKTIENGESELLSCHAFT (DT) | 1978-01-17 | — | — | US | disclosed |