⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15345 | 0.94 | — | — | |
| SCHEMBL28176162 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL9929515 | 0.90 | — | — | |
| SCHEMBL7160858 | 0.90 | — | — | |
| SCHEMBL27387041 | 0.90 | — | — | |
| SCHEMBL8073511 | 0.90 | — | — | |
| SCHEMBL22462716 | 0.90 | — | — | |
| SCHEMBL11759138 | 0.90 | — | — | |
| SCHEMBL20543433 | 0.90 | — | — | |
| Ethylene SCHEMBL29100489 | 0.88 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116239562-A | Method for synthesizing doxepin hydrochloride by taking benzofuranone as raw material | 江苏师范大学 | 2023-06-09 | — | — | CN | claimed |
| CN-109503421-B | Method for improving safety of azide amine fuel synthesis process | 黎明化工研究设计院有限责任公司 | 2022-10-14 | — | — | CN | claimed |
| CN-114341121-B | Fluorine-containing ether compound, lubricant for magnetic recording medium, and magnetic recording medium | 株式会社力森诺科 | 2024-03-15 | — | — | CN | disclosed |
| CN-116239562-A | Method for synthesizing doxepin hydrochloride by taking benzofuranone as raw material | 江苏师范大学 | 2023-06-09 | — | — | CN | disclosed |
| CN-109503421-B | Method for improving safety of azide amine fuel synthesis process | 黎明化工研究设计院有限责任公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-114341121-A | Fluorinated ether compound, lubricant for magnetic recording medium, and magnetic recording medium | 昭和电工株式会社 | 2022-04-12 | — | — | CN | disclosed |
| WO-2021065382-A1 | FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM | 昭和電工株式会社 | 2021-04-08 | — | — | WO | disclosed |
| CN-109503612-B | Structure modifier of 8-methoxypsoralen and preparation method and application thereof | 北京农学院 | 2020-06-16 | — | — | CN | disclosed |
| CN-1415125-A | Lithium battery pack | MOLTECH CORP (US) | 2003-04-30 | — | — | CN | disclosed |
| US-5863438-A | Processes for deionization and demineralization of fluids | CULLIGAN INTERNATIONAL COMPANY (US) | 1999-01-26 | — | — | US | disclosed |
| US-5665239-A | Processes for deionization and demineralization of fluids | CULLIGAN INTERNATIONAL COMPANY (US) | 1997-09-09 | — | — | US | disclosed |
| WO-1997026065-A1 | PROCESSES FOR DEIONIZATION AND DEMINERALIZATION OF FLUIDS | CULLIGAN INTERNATIONAL COMPANY (US) | 1997-07-24 | — | — | WO | disclosed |
| EP-0229329-B1 | BENZAZEPINE DERIVATIVES | E.R. Squibb & Sons, Inc. (US) | 1993-07-28 | — | — | EP | disclosed |