⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1004273 | 1.00 | — | — | |
| SCHEMBL1782545 | 1.00 | — | — | |
| SCHEMBL17062939 | 0.84 | — | — | |
| SCHEMBL1787244 | 0.84 | — | — | |
| SCHEMBL1787241 | 0.84 | — | — | |
| SCHEMBL1783716 | 0.82 | EP300 (0.48) | — | |
| SCHEMBL1783718 | 0.82 | EP300 (0.48) | — | |
| SCHEMBL1129943 | 0.80 | TSHR (0.52) | — | |
| SCHEMBL1130215 | 0.80 | TSHR (0.52) | — | |
| SCHEMBL1785247 | 0.80 | TSHR (0.52) | — |
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 145 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106795174-B | Antiviral active diazacyclospirodiketopiperazine alkaloid derivative and preparation method thereof | 扬州蓝色生物医药科技有限公司 | 2020-04-28 | — | — | CN | claimed |
| US-20170291866-A1 | Production of Mixed Aldol Products from the Products of Hydroformylation Reactions | Texmark Chemicals, Inc. (US) | 2017-10-12 | — | — | US | claimed |
| US-9688599-B2 | Production of mixed aldol products from the products of hydroformylation reactions | Texmark Chemicals, Inc. (US) | 2017-06-27 | — | — | US | claimed |
| CN-105237350-A | Butyl alcohol and 2-ethyl hexanol production equipment industrial waste comprehensive utilization method | TIANJIN BOHUA YONGLI CHEMICAL INDUSTRY CO LTD | 2016-01-13 | — | — | CN | claimed |
| US-20150299081-A1 | Production of Mixed Aldol Products from the Products of Hydroformylation Reactions | Texmark Chemicals, Inc. (US) | 2015-10-22 | — | — | US | claimed |
| WO-2015161321-A1 | PRODUCTION OF MIXED ALDOL PRODUCTS FROM THE PRODUCTS OF HYDROFORMYLATION REACTIONS | Texmark Chemicals, Inc. (US) | 2015-10-22 | — | — | WO | claimed |
| CN-122059804-A | Method for preparing octenol by hydrogenation of octenal | 中国石油化工股份有限公司 | 2026-05-19 | — | — | CN | disclosed |
| CN-122057507-A | Copper-based catalyst prepared by coprecipitation method and preparation method thereof, and method for preparing octenol | 中国石油化工股份有限公司 | 2026-05-19 | — | — | CN | disclosed |
| CN-122057508-A | Supported catalyst prepared by adopting deposition precipitation method, preparation method thereof and method for preparing octenol | 中国石油化工股份有限公司 | 2026-05-19 | — | — | CN | disclosed |
| US-20250250370-A1 | METHACRYLATE-CONTAINING COMPOSITION, METHOD FOR PRODUCING METHACRYLIC ESTER, POLYMERIZABLE COMPOSITION, AND METHOD FOR PRODUCING METHACRYLIC ACID POLYMER | MITSUBISHI CHEMICAL CORPORATION (JP) | 2025-08-07 | — | — | US | disclosed |
| CN-119923418-A | Methacrylic acid-containing composition, method for producing methacrylic acid ester, polymerizable composition, and method for producing methacrylic acid polymer | 三菱化学株式会社 | 2025-05-02 | — | — | CN | disclosed |
| US-20240228793-A1 | POWDER COATING COMPOSITION BLEND | ALLNEX NETHERLANDS B.V. (NL) | 2024-07-11 | — | — | US | disclosed |
| CN-118176275-A | Method for producing engine fuel from ethanol | 瑞典生物燃料股份公司 | 2024-06-11 | — | — | CN | disclosed |
| US-4749728-A | HAVING HYDROXY-FUNCTIONAL AND CARBOXYLIC ESTER-FUNCTIONAL RESINS OR COMPONENTS | THE GLIDDEN COMPANY (US) | 1988-06-07 | — | — | US | disclosed |
| US-4742096-A | EPOXIDE AND PHOSPHONIUM OR AMMONIUM SALT | THE GLIDDEN COMPANY (US) | 1988-05-03 | — | — | US | disclosed |
| EP-0252289-A2 | Transesterification catalysts and thermoset coatings | THE GLIDDEN COMPANY (US) | 1988-01-13 | — | — | EP | disclosed |
| EP-0087712-B1 | METHOD FOR THE PREPARATION OF 3-CYANO-2-ALKYL ALKANALS AND USE OF 3-CYANO-2-ETHYL HEXANAL IN THE PREPARATION OF 2-PROPYLPENTANOIC ACID | BASF Aktiengesellschaft (DE) | 1986-05-07 | — | — | EP | disclosed |
| US-4532082-A | Preparation of 3-cyano-2-alkylalkanals | BASF AKTIENGESELLSCHAFT (DE) | 1985-07-30 | — | — | US | disclosed |
| EP-0087712-A1 | Method for the preparation of 3-cyano-2-alkyl alkanals and use of 3-cyano-2-ethyl hexanal in the preparation of 2-propylpentanoic acid | BASF Aktiengesellschaft (DE) | 1983-09-07 | — | — | EP | disclosed |
| US-4203898-A | ANTICARCINOGENIC | ELI LILLY AND COMPANY (US) | 1980-05-20 | — | — | US | disclosed |