⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL28933220 | 0.86 | FFAR3 (0.47) | — | |
| 1,4-Butanediol SCHEMBL27650309 | 0.84 | — | — | |
| Propanol SCHEMBL27720980 | 0.84 | — | — | |
| Acetaldehyde SCHEMBL3400941 | 0.82 | — | — | |
| Acetaldehyde SCHEMBL20959767 | 0.82 | — | — | |
| Acetaldehyde SCHEMBL662140 | 0.82 | — | — | |
| Propanol SCHEMBL27720977 | 0.81 | ALDH1A1 (0.43) | — | |
| Monoethanolamine SCHEMBL1271398 | 0.81 | — | — | |
| Propanol SCHEMBL27720985 | 0.81 | — | — | |
| Acetaldehyde SCHEMBL4150720 | 0.78 | — | — |
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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380830-A | Synthesis process of doxofylline | 赤峰万泽药业股份有限公司 | 2022-04-22 | — | — | CN | claimed |
| CN-106729902-B | A kind of antibacterial and mouldproof removes active material of formaldehyde and preparation method thereof | 闽南师范大学 | 2019-06-18 | — | — | CN | claimed |
| CN-105504117-B | A kind of preparation method of high tenacity low water absorbable carbon oxygen cross-linking polyvinyl alcohol acetal insulating materials | 营口天元化工研究所股份有限公司 | 2018-04-20 | — | — | CN | claimed |
| CN-106729902-A | A kind of antibacterial and mouldproof removes active material of formaldehyde and preparation method thereof | 闽南师范大学 | 2017-05-31 | — | — | CN | claimed |
| CN-105504117-A | Preparation method of high-tenacity low-water absorbability carbon-oxygen-crosslinked polyvinyl acetal insulating material | YINGKOU TANYUN CHEMICAL RES INST CORP | 2016-04-20 | — | — | CN | claimed |
| CN-104945235-A | Method for extracting acetaldehyde and ethylene glycol from polyester wastewater | JIANGSU HUAYA CHEMICAL FIBER CO LTD | 2015-09-30 | — | — | CN | claimed |
| CN-117940419-A | Prodrugs of pyrrolidone derivatives as glucokinase activators | 华领医药技术（上海）有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-111995625-B | Preparation method of doxofylline | 开封康诺药业有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-115260957-B | Low-temperature-curing bi-component silver conductive adhesive containing conductive auxiliary agent and preparation method thereof | 深圳市计量质量检测研究院 | 2024-01-09 | — | — | CN | disclosed |
| CN-116635464-A | Polyester recycling process with pre-reaction purification | 国际商业机器公司 | 2023-08-22 | — | — | CN | disclosed |
| CN-115570131-A | High-conductivity silver-plated copper powder, preparation method and conductive adhesive | 昆明高聚科技有限公司 | 2023-01-06 | — | — | CN | disclosed |
| CN-115260957-A | Low-temperature curing bi-component silver conductive adhesive containing conductive auxiliary agent and preparation method thereof | 深圳市计量质量检测研究院 | 2022-11-01 | — | — | CN | disclosed |
| CN-114380830-A | Synthesis process of doxofylline | 赤峰万泽药业股份有限公司 | 2022-04-22 | — | — | CN | disclosed |
| WO-2000032772-A2 | ERYTHROPOIETIC COMPOUNDS | ELI LILLY AND COMPANY (US) | 2000-06-08 | — | — | WO | disclosed |
| EP-0994146-A1 | Solid state polymerization of PET flakes | ILLINOIS TOOL WORKS INC. (US) | 2000-04-19 | — | — | EP | disclosed |
| EP-0774998-A4 | SYNERGISTIC SURFACTANT COMPOSITIONS AND FIRE FIGHTING CONCENTRATES THEREOF | DYNAX CORP (US) | 1999-06-16 | — | — | EP | disclosed |
| EP-0774998-A1 | SYNERGISTIC SURFACTANT COMPOSITIONS AND FIRE FIGHTING CONCENTRATES THEREOF | DYNAX CORPORATION (US) | 1997-05-28 | — | — | EP | disclosed |
| US-5616273-A | FIRE FIGHTING FOAM | DYNAX CORPORATION (US) | 1997-04-01 | — | — | US | disclosed |
| WO-1996004961-A9 | SYNERGISTIC SURFACTANT COMPOSITIONS AND FIRE FIGHTING CONCENTRATES THEREOF | — | 1996-04-25 | — | — | WO | disclosed |
| WO-1996004961-A1 | SYNERGISTIC SURFACTANT COMPOSITIONS AND FIRE FIGHTING CONCENTRATES THEREOF | DYNAX CORPORATION (US) | 1996-02-22 | — | — | WO | disclosed |