⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18804001 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL10551777 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL29726945 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL11069629 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL2481345 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL9717348 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL1524410 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL2705613 | 1.00 | ALDH1A1 (0.41) | — | |
| SCHEMBL1141520 | 0.97 | — | — | |
| SCHEMBL1524228 | 0.89 | TSHR (0.42) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115160123-B | Method for preparing carboxylic acid compound by oxidizing alcohol by using oxygen as oxidant under catalysis of copper | 复旦大学 | 2024-07-30 | — | — | CN | disclosed |
| WO-2023232002-A1 | METHOD FOR PREPARING CARBOXYLATE BY MEANS OF IRON-CATALYZED OXIDATION AND ESTERIFICATION OF ALCOHOL | 复旦大学 | 2023-12-07 | — | — | WO | disclosed |
| US-11407726-B2 | Using stereoretention for the stereoselective formation of e-macrocycles with Ru-based olefin metathesis catalysts | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2022-08-09 | — | — | US | disclosed |
| US-20200385360-A1 | USING STEREORETENTION FOR THE STEREOSELECTIVE FORMATION OF E-MACROCYCLES WITH RU-BASED OLEFIN METATHESIS CATALYSTS | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2020-12-10 | — | — | US | disclosed |
| EP-2943722-B1 | PROTECTIVE COATING FOR LED LAMP | CREE INC (US) | 2019-08-28 | — | — | EP | disclosed |
| US-9570661-B2 | Protective coating for LED lamp | CREE, INC. (US) | 2017-02-14 | — | — | US | disclosed |
| EP-2943722-A1 | PROTECTIVE COATING FOR LED LAMP | Cree, Inc. (US) | 2015-11-18 | — | — | EP | disclosed |
| WO-2014110211-A1 | PROTECTIVE COATING FOR LED LAMP | CREE, INC. (US) | 2014-07-17 | — | — | WO | disclosed |
| US-20140191648-A1 | PROTECTIVE COATING FOR LED LAMP | CREE, INC. (US) | 2014-07-10 | — | — | US | disclosed |
| US-7619125-B2 | Hydrogenation promoter, hydrogenation catalyst, and process for producing alkene compound | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 2009-11-17 | — | — | US | disclosed |
| US-7446226-B2 | Phenylhept-6-yne-acid-4-hydroxy-3-methoxylbenzylamide (phenylcapsaicin); use as microorganism repellent agents in paints and coatings, for marine installations and ships, but also for land-based structures; nontoxic | AXIMED AS (NO) | 2008-11-04 | — | — | US | disclosed |
| US-20080033221-A1 | Hydrogenation Promoter, Hydrogenation Catalyst, and Process for Producing Alkene Compound | NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) | 2008-02-07 | — | — | US | disclosed |
| US-20070167524-A1 | Capsaicin derivates and the production and use thereof | AXICHEM AB (SE) | 2007-07-19 | — | — | US | disclosed |
| US-3954851-A | PROSTAGLANDINS | THE UPJOHN COMPANY (US) | 1976-05-04 | — | — | US | disclosed |