⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19874837 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL2325983 | 0.77 | CA2 (0.30) | — | |
| SCHEMBL28176120 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL196941 | 0.72 | CES2 (0.33) | — | |
| SCHEMBL2133814 | 0.72 | ALDH1A1 (0.42) | — | |
| SCHEMBL15737166 | 0.71 | — | — | |
| Water SCHEMBL3827001 | 0.70 | CES2 (0.32) | — | |
| SCHEMBL1681634 | 0.70 | — | — | |
| SCHEMBL3149097 | 0.69 | — | — | |
| SCHEMBL4377472 | 0.69 | — | — |
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 192 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120004845-A | Preparation method of 2, 2-dimethoxy-4- (trifluoromethyl) -1, 3-dioxolane | 张家港市国泰华荣化工新材料有限公司 | 2025-05-16 | — | — | CN | claimed |
| WO-2025091685-A1 | FLUORINATED LIQUID COMPOSITION AND USE THEREOF | 深圳市鸿富诚新材料股份有限公司 | 2025-05-08 | — | — | WO | claimed |
| CN-117603661-A | Fluorinated liquid composition and application thereof | 武汉肯达科讯科技有限公司 | 2024-02-27 | — | — | CN | claimed |
| CN-113659213-B | Low-temperature electrolyte and application thereof | 常州高态信息科技有限公司 | 2023-12-01 | — | — | CN | claimed |
| CN-115513522-A | Electrolyte using fluorine-containing ester compound as diluent and lithium battery | 北京理工大学深圳汽车研究院(电动车辆国家工程实验室深圳研究院) | 2022-12-23 | — | — | CN | claimed |
| CN-113659213-A | Low-temperature electrolyte and application | 常州高态信息科技有限公司 | 2021-11-16 | — | — | CN | claimed |
| CN-113185636-A | Short-fluorocarbon-chain acrylate polymer, preparation method thereof and application of short-fluorocarbon-chain acrylate polymer in mold release agent | 浙江工业大学 | 2021-07-30 | — | — | CN | claimed |
| CN-111138256-B | Preparation method of hexanediol | 中国科学院大连化学物理研究所 | 2021-07-13 | — | — | CN | claimed |
| CN-111138257-B | Method for preparing hexanedial | 中国科学院大连化学物理研究所 | 2021-06-22 | — | — | CN | claimed |
| CN-111138255-B | Process for preparing hexanedial from cyclohexene | 中国科学院大连化学物理研究所 | 2021-06-22 | — | — | CN | claimed |
| CN-111138255-A | Process for preparing hexanedial from cyclohexene | 中国科学院大连化学物理研究所 | 2020-05-12 | — | — | CN | claimed |
| CN-111138257-A | Method for preparing hexanedial | 中国科学院大连化学物理研究所 | 2020-05-12 | — | — | CN | claimed |
| CN-111138256-A | Preparation method of hexanediol | 中国科学院大连化学物理研究所 | 2020-05-12 | — | — | CN | claimed |
| CN-111138295-A | Preparation process of hexamethylene diamine based on cyclohexene | 中国科学院大连化学物理研究所 | 2020-05-12 | — | — | CN | claimed |
| CN-111072487-A | Method for preparing hexamethylene diamine based on cyclohexene | 中国科学院大连化学物理研究所 | 2020-04-28 | — | — | CN | claimed |
| CN-111072488-A | Preparation process of hexamethylene diamine based on cyclohexene | 中国科学院大连化学物理研究所 | 2020-04-28 | — | — | CN | claimed |
| CN-111056955-A | Method for preparing hexamethylene diamine from cyclohexene | 中国科学院大连化学物理研究所 | 2020-04-24 | — | — | CN | claimed |
| US-20030194378-A1 | Novel aerosol formulation containing a polar fluorinated molecule | ASTRAZENECA AB (SE) | 2003-10-16 | — | — | US | claimed |
| EP-1303258-A1 | NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE | AstraZeneca AB (SE) | 2003-04-23 | — | — | EP | claimed |
| WO-2002003958-A1 | NOVEL AEROSOL FORMULATION CONTAINING A POLAR FLUORINATED MOLECULE | ASTRAZENECA AB (SE) | 2002-01-17 | — | — | WO | claimed |