⚠ 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 | |
|---|---|---|---|---|
| Ether SCHEMBL2256287 | 0.91 | ALDH1A1 (0.48) | — | |
| Ether SCHEMBL22190214 | 0.88 | ALDH1A1 (0.37) | — | |
| Ether SCHEMBL9274391 | 0.88 | ALDH1A1 (0.37) | — | |
| Hexane SCHEMBL1671521 | 0.88 | TSHR (0.42) | — | |
| Ether SCHEMBL27515782 | 0.86 | TSHR (0.36) | — | |
| Propylene Glycol SCHEMBL7668808 | 0.82 | TDP1 (0.48) | — | |
| Ether SCHEMBL7593160 | 0.81 | — | — | |
| Ether SCHEMBL15229125 | 0.81 | — | — | |
| Ether SCHEMBL7196847 | 0.80 | — | — | |
| Ether SCHEMBL3099495 | 0.79 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230303542-A1 | SOLID FORMS OF A PARP14 INHIBITOR | ABBVIE BIOTECHNOLOGY LTD (BM) | 2023-09-28 | — | — | US | disclosed |
| CN-112694544-B | Glycan derivative and preparation method and application thereof | 湖南鑫恒环境科技有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-112694544-A | Glycan derivative and preparation method and application thereof | 湖南鑫恒环境科技有限公司 | 2021-04-23 | — | — | CN | disclosed |
| CN-109337038-A | A kind of 2,5-Dihydroxyterephthalic acid polyurethane and its preparation method and application | 东北师范大学 | 2019-02-15 | — | — | CN | disclosed |
| US-7348436-B2 | Compounds useful for the synthesis of (+)-discodermolide and methods thereof | KOSAN BIOSCIENCES INCORPORATED (US) | 2008-03-25 | — | — | US | disclosed |
| WO-2005084349-A2 | COMPOUNDS USEFUL FOR THE SYNTHESIS OF (+)-DISCODERMOLIDE AND METHODS THEREFOR | KOSAN BIOSCIENCES, INC. (US) | 2005-09-15 | — | — | WO | disclosed |
| US-20050197369-A1 | Compounds useful for the synthesis of (+)-discodermolide and methods therefor | KOSAN BIOSCIENCES, INC. (US) | 2005-09-08 | — | — | US | disclosed |
| US-6491729-B1 | Dry-cleaning solvent composition | Lee, Chin Yen (TW) | 2002-12-10 | — | — | US | disclosed |
| US-6395522-B1 | APPARATUS FOR USE WATER TREATMENT; POLLUTION CONTROL | ALLIEDSIGNAL INC. | 2002-05-28 | — | — | US | disclosed |
| WO-1998039347-A2 | SYNTHESIS OF L-RIBOSE AND 2-DEOXY L-RIBOSE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1998-09-11 | — | — | WO | disclosed |
| EP-0512352-B1 | Substituted carboxylic acid derivatives | HOFFMANN LA ROCHE (CH) | 1996-03-27 | — | — | EP | disclosed |
| US-5344843-A | Carnitine acryltransferase enzyme inhibitors as antiischemic agents and for cardiovascular disorders | HOFFMAN-LA ROCHE INC. (US) | 1994-09-06 | — | — | US | disclosed |
| EP-0512352-A2 | Substituted carboxylic acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1992-11-11 | — | — | EP | disclosed |
| US-5047469-A | Novel polyvinyl alcohol and process for producing polyvinyl alcohol by hydrolysis catalyzed by acids | KURARAY CO., LTD. (JP) | 1991-09-10 | — | — | US | disclosed |
| EP-0306531-A1 | FLEXIBLE HEAT TRANSFER STRUCTURE AND METHOD OF MANUFACTURING SAME | TORAY INDUSTRIES, INC. (JP) | 1989-03-15 | — | — | EP | disclosed |
| EP-0135349-B1 | CONDENSED SEVEN-MEMBERED RING COMPOUNDS AND THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1988-11-02 | — | — | EP | disclosed |