⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL179916 | 1.00 | — | — | |
| SCHEMBL8436206 | 1.00 | — | — | |
| SCHEMBL8861236 | 0.96 | — | — | |
| Alcohol SCHEMBL10597860 | 0.89 | — | — | |
| Trimethylammonium SCHEMBL16632667 | 0.87 | TRPA1 (0.30) | — | |
| Trimethylammonium SCHEMBL16632668 | 0.87 | TRPA1 (0.30) | — | |
| Butadiene SCHEMBL8861158 | 0.87 | — | — | |
| Butadiene SCHEMBL8861155 | 0.87 | — | — | |
| SCHEMBL9735986 | 0.77 | ALDH1A1 (0.34) | — | |
| SCHEMBL38736 | 0.77 | — | — |
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 598 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116063199-B | Polymerization inhibitor and preparation method thereof, and method for co-producing benzyl alcohol and alkylene oxide | 万华化学集团股份有限公司 | 2024-11-12 | — | — | CN | claimed |
| CN-115074115-B | Method for modifying surface defects of quantum dots, quantum dot product and application | 合肥福纳科技有限公司 | 2024-09-24 | — | — | CN | claimed |
| CN-117965157-A | Multifunctional foam fluid for low-permeability low-pressure gas reservoir and preparation method thereof | 四川川庆井下科技有限公司 | 2024-05-03 | — | — | CN | claimed |
| CN-117567068-A | Waterproof rebound inhibition tackifier, preparation and use methods and application thereof | 中国铁道科学研究院集团有限公司铁道建筑研究所 | 2024-02-20 | — | — | CN | claimed |
| CN-117362507-A | Super macroporous hydrophilic microsphere and preparation method thereof | 青岛科诺赛生物科技有限公司 | 2024-01-09 | — | — | CN | claimed |
| CN-115232261-B | Hybrid gelatinizer for oilfield acidification based on POSS (polyhedral oligomeric silsesquioxanes) based cross-linking agent and preparation method thereof | 四川川庆井下科技有限公司 | 2023-11-24 | — | — | CN | claimed |
| CN-116903923-B | Method for synthesizing thermal expansion foaming agent | 潍坊裕凯化工有限公司 | 2023-11-21 | — | — | CN | claimed |
| CN-116722144-B | Hydrophobic modifier, hydrophobic layer slurry, modified lithium negative electrode, lithium battery, and preparation methods and applications of hydrophobic modifier and hydrophobic layer slurry and modified lithium negative electrode | 北京金羽新材科技有限公司 | 2023-11-07 | — | — | CN | claimed |
| CN-117012936-A | High-energy-density quick-charge graphite negative electrode material, preparation method thereof, negative electrode plate and battery | 深圳市贝特瑞新能源技术研究院有限公司 | 2023-11-07 | — | — | CN | claimed |
| CN-116903923-A | Method for synthesizing thermal expansion foaming agent | 潍坊裕凯化工有限公司 | 2023-10-20 | — | — | CN | claimed |
| US-5288903-A | Catalytic reaction of chlorobutenes with carbon monoxide to pentenoyl chloride; forming palladium catalyst; reacting with butadiene, water to acid | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-02-22 | — | — | US | claimed |
| US-5091122-A | Using a tertiary amine or phosphine substituted polymer | IDEMITSU KOSAN COMPANY, LTD. (JP) | 1992-02-25 | — | — | US | claimed |
| EP-0272191-B1 | PROCESS FOR THE PREPARATION OF DIESTERS OF HEXENEDIOIC ACID | RHONE-POULENC CHIMIE (FR) | 1991-02-27 | — | — | EP | claimed |
| EP-0397793-A1 | SELECTIVE EPOXIDATION OF OLEFINS | EASTMAN KODAK COMPANY (US) | 1990-11-22 | — | — | EP | claimed |
| US-4950773-A | IN PRESENCE OF SILVER CATALYST AND ORGANIC HALIDE | EASTMAN KODAK COMPANY (US) | 1990-08-21 | — | — | US | claimed |
| US-4857657-A | Preparation of hexenedioic acid diesters | RHONE-POULENC CHIMIE (FR) | 1989-08-15 | — | — | US | claimed |
| WO-1989007101-A1 | SELECTIVE EPOXIDATION OF OLEFINS | EASTMAN KODAK COMPANY (US) | 1989-08-10 | — | — | WO | claimed |
| EP-0326392-A1 | Selective epoxidation of olefins | EASTMAN CHEMICAL COMPANY (US) | 1989-08-02 | — | — | EP | claimed |
| EP-0272191-A1 | Process for the preparation of diesters of hexenedioic acid | RHONE-POULENC CHIMIE (FR) | 1988-06-22 | — | — | EP | claimed |
| US-4018836-A | Production of monochloro-substituted saturated compounds | UOP INC. (US) | 1977-04-19 | — | — | US | claimed |