⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL6359933 | 0.96 | — | — | |
| SCHEMBL7795764 | 0.96 | TSHR (0.35) | — | |
| Octane SCHEMBL9437891 | 0.81 | TSHR (0.40) | — | |
| SCHEMBL6302668 | 0.77 | TSHR (0.38) | — | |
| SCHEMBL111121 | 0.77 | — | — | |
| SCHEMBL4119722 | 0.77 | TSHR (0.38) | — | |
| SCHEMBL2913051 | 0.76 | — | — | |
| SCHEMBL11632595 | 0.75 | NAAA (0.35) | — | |
| SCHEMBL11733608 | 0.72 | — | — | |
| SCHEMBL11733615 | 0.72 | — | — |
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
Appears in 5510 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120161081-A | A purity detects frock for tertiary butyl isocyanate | 湖南道仕医药科技有限公司 | 2025-06-17 | — | — | CN | claimed |
| CN-118440295-B | Unsaturated dibasic acid modified alkali-soluble epoxy acrylic resin and preparation method and application thereof | 广东三求光固材料股份有限公司 | 2025-05-27 | — | — | CN | claimed |
| CN-119977527-A | Preparation method of magnesia carbon refractory castable | 宜兴市东坡耐火材料有限公司 | 2025-05-13 | — | — | CN | claimed |
| CN-119954686-A | Preparation method of high-purity tertiary butyl isocyanate | 江西道仕化学有限公司 | 2025-05-09 | — | — | CN | claimed |
| CN-116396344-B | Application of natural flavonoid glycoside in preparation of drugs for treating glycolipid metabolism comprehensive disturbance | 江苏灵源沂岸科技股份有限公司 | 2025-04-29 | — | — | CN | claimed |
| CN-119769526-A | Visible light photocatalytic disinfectant for aerosol-attached pathogenic bacteria in emergency room, and preparation method and application thereof | 中北大学 | 2025-04-08 | — | — | CN | claimed |
| CN-119661775-A | Water-based polymer dispersing agent and preparation method and application thereof | 上海宇昂水性新材料科技股份有限公司 | 2025-03-21 | — | — | CN | claimed |
| CN-119432170-A | Hydrophobic film and coating liquid used for same, preparation method and application | 伊利伊诺科技(上海)有限责任公司 | 2025-02-14 | — | — | CN | claimed |
| US-20250051268-A1 | METHOD FOR PREPARING ISOCYANATE BY MEANS OF GAS-PHASE SOLVENT-FREE METHOD | MOJIA (SHANGHAI) BIOTECH CO., LTD. (CN) | 2025-02-13 | — | — | US | claimed |
| CN-119285502-A | Free radical self-release antifouling agent containing oxime urethane group and preparation method and application thereof | 哈尔滨工程大学 | 2025-01-10 | — | — | CN | claimed |
| EP-0638066-A1 | CARBODIIMIDES AND PROCESSES THEREFOR. | DU PONT (US) | 1995-02-15 | — | — | EP | claimed |
| US-5352400-A | Carbodiimides and processes therefor | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-10-04 | — | — | US | claimed |
| WO-1993022282-A2 | CARBODIIMIDES AND PROCESSES THEREFOR | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-11-11 | — | — | WO | claimed |
| US-5032144-A | Gasoline additives | UNION OIL COMPANY OF CALIFORNIA (US) | 1991-07-16 | — | — | US | claimed |
| EP-0208187-B1 | GRAFT POLYMERS AND THEIR MIXTURES WITH POLYAMIDES | BAYER AG (DE) | 1990-11-07 | — | — | EP | claimed |
| US-4873289-A | ELASTOMER BASE AND GRAFTED ON VINYL MONOMER | BAYER AKTIENGESELLSCHAFT (DE) | 1989-10-10 | — | — | US | claimed |
| US-4544743-A | Salts of 1,3,5-oxadiazines-2,4,6-triones, 1,3,5-oxadiazines-2,4,6-triones and the preparation thereof | SOCIETE CARBOCHIMIQUE (BE) | 1985-10-01 | — | — | US | claimed |
| US-4482691-A | Air-drying fatty acid-modified acrylic resins | PPG INDUSTRIES, INC. (US) | 1984-11-13 | — | — | US | claimed |
| US-4366317-A | Process for synthesis of N-(hydrocarbyl)substituted-p-menthane-3-carboxamide | PHILIP MORRIS INCORPORATED (US) | 1982-12-28 | — | — | US | claimed |
| US-4350832-A | Synthesis of N-t-butyl-p-menthane-3-carboxamide | PHILIP MORRIS, INCORPORATED (US) | 1982-09-21 | — | — | US | claimed |