⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20446686 | 1.00 | — | — | |
| Acetic Acid SCHEMBL28019649 | 0.89 | CHRM1 (0.38) | — | |
| SCHEMBL681697 | 0.86 | — | — | |
| SCHEMBL21671008 | 0.81 | TSHR (0.38) | — | |
| Acetic Acid Propyl Ester SCHEMBL1871462 | 0.80 | ALDH1A1 (0.41) | — | |
| SCHEMBL7963776 | 0.75 | — | — | |
| SCHEMBL11888376 | 0.74 | OPRM1 (0.40) | — | |
| SCHEMBL385919 | 0.74 | — | — | |
| SCHEMBL14813217 | 0.73 | CHRM1 (0.41) | — | |
| SCHEMBL24071227 | 0.72 | LMNA (0.41) | — |
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 1578 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111051483-B | Esters and ethers of 2, 4-tetramethyl cyclobutane-1, 3-diol as fragrance chemicals | 巴斯夫欧洲公司 | 2025-01-24 | — | — | CN | claimed |
| US-12187978-B2 | Use of (3-acetoxy-2,2-dimethyl-propyl) acetate in combination with (3-hydroxy-2,2-dimethyl-propyl) acetate as an aroma chemical | BASF SE (DE) | 2025-01-07 | — | — | US | claimed |
| CN-119255781-A | Antimicrobial mixtures | 西姆莱斯股份公司 | 2025-01-03 | — | — | CN | claimed |
| CN-119097073-A | Passion fruit essence and preparation method thereof | 浙江澳杰生物技术有限公司 | 2024-12-10 | — | — | CN | claimed |
| US-20240224994-A1 | INSECT REPELLANT FORMULATION AND METHOD OF USING SAME | UNITED INDUSTRIES CORPORATION | 2024-07-11 | — | — | US | claimed |
| CN-114007660-B | Refreshing composition and method for atomizing refreshing composition by using heat-activated microfluidic cartridge | 宝洁公司 | 2024-07-05 | — | — | CN | claimed |
| CN-114874413-B | Dispersing resin for cathode electrophoretic coating matched with film pretreatment and preparation method and application thereof | 上海金力泰化工股份有限公司 | 2024-03-01 | — | — | CN | claimed |
| CN-116970109-B | Sulfoxide group-containing acrylate polymer, preparation method thereof and application thereof in resisting tissue adhesion | 浙江大学 | 2024-02-27 | — | — | CN | claimed |
| US-11844854-B2 | Fragrance materials | THE PROCTER & GAMBLE COMPANY (US) | 2023-12-19 | — | — | US | claimed |
| WO-2023222577-A1 | ANTIMICROBIAL MIXTURES | SYMRISE AG (DE) | 2023-11-23 | — | — | WO | claimed |
| US-20080020317-A1 | Novel metal nanoparticle and formation of conductive pattern using the same | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2008-01-24 | — | — | US | claimed |
| CN-101076912-A | Coolant composition for fuel cell | SHISHIAI KK (JP) | 2007-11-21 | — | — | CN | claimed |
| EP-1855340-A1 | COOLANT COMPOSITION FOR FUEL CELL | Shishiai-Kabushikigaisha (JP) | 2007-11-14 | — | — | EP | claimed |
| CN-1573543-A | Photosensitive metal nanoparticle and method of forming conductive pattern using the same | SAMSUNG ELECTRONICS CO LTD (KR) | 2005-02-02 | — | — | CN | claimed |
| EP-1500978-A2 | Photosensitive metal nanoparticle and method of forming conductive pattern using the same | Samsung Electronics Co., Ltd. (KR) | 2005-01-26 | — | — | EP | claimed |
| US-20040253536-A1 | Photosensitive metal nanoparticle and method of forming conductive pattern using the same | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2004-12-16 | — | — | US | claimed |
| US-6322838-B1 | Mint and/or fruit flavor compositions | HAARMANN & REIMER GMBH (DE) | 2001-11-27 | — | — | US | claimed |
| US-5919552-A | Coated substrates and methods | XEROX CORPORATION (US) | 1999-07-06 | — | — | US | claimed |
| US-5897961-A | USEFUL FOR INK JET PRINTING AND ELECTROSTATIC PRINTING | XEROX CORPORATION (US) | 1999-04-27 | — | — | US | claimed |
| US-5763128-A | Simulated photographic-quality images on a substrate without curl | XEROX CORPORATION (US) | 1998-06-09 | — | — | US | claimed |