⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2652403 | 0.97 | — | — | |
| SCHEMBL28315460 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL28260265 | 0.97 | — | — | |
| Methyl Alcohol SCHEMBL28719231 | 0.97 | — | — | |
| Methoxymethane SCHEMBL8734452 | 0.97 | TSHR (0.67) | — | |
| Acetic Acid SCHEMBL15924510 | 0.92 | TSHR (0.60) | — | |
| Acetic Acid SCHEMBL1834707 | 0.92 | TSHR (0.60) | — | |
| Acetic Acid Methyl Ester SCHEMBL4693939 | 0.92 | TSHR (0.60) | — | |
| Sulfuric Acid SCHEMBL27891518 | 0.87 | TSHR (0.55) | — | |
| SCHEMBL20022345 | 0.85 | 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
Appears in 6004 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 |
|---|---|---|---|---|---|---|---|
| US-20260051541-A1 | ELECTROLYTE SOLUTION COMPOSITION FOR SECONDARY BATTERY AND SECONDARY BATTERY COMPRISING THE SAME | ZF SOLUTION CO LTD (KR) | 2026-02-19 | — | — | US | claimed |
| US-12365641-B2 | Method for preparing 1,3-propanediol with high space-time yield and high concentration | LANZHOU INSTITUTE OF CHEMICAL PHYSICS, CHINESE ACADEMY OF SCIENCES (CN) | 2025-07-22 | — | — | US | claimed |
| CN-119819323-A | Cu-based ester hydrogenation catalyst prepared by multi-step method and application thereof | 中化泉州石化有限公司 | 2025-04-15 | — | — | CN | claimed |
| US-20250074856-A1 | POLYPHOSHATES AND POLYPHOSPHONATES AS RATE PROMOTERS FOR THE GLACIAL ACETIC ACID PROCESS | LYONDELLBASELL ACETYLS, LLC (US) | 2025-03-06 | — | — | US | claimed |
| US-20250011262-A1 | METHOD FOR PREPARING 1,3-PROPANEDIOL WITH HIGH SPACE-TIME YIELD AND HIGH CONCENTRATION | LANZHOU INSTITUTE OF CHEMICAL PHYSICS, CHINESE ACADEMY OF SCIENCES (CN) | 2025-01-09 | — | — | US | claimed |
| CN-118847122-A | Multi-component composite catalyst for preparing 1, 3-propanediol by hydrogenating methyl 3-hydroxypropionate and preparation method thereof | 中化泉州石化有限公司 | 2024-10-29 | — | — | CN | claimed |
| US-20240343683-A1 | SYSTEMS AND METHODS FOR PRODUCING NITRILES | Alliance for Energy Innovation, LLC | 2024-10-17 | — | — | US | claimed |
| CN-118698557-A | Multi-component composite catalyst for preparing 1, 3-propanediol by hydrogenating methyl 3-hydroxypropionate and preparation method thereof | 中化泉州石化有限公司 | 2024-09-27 | — | — | CN | claimed |
| CN-118620143-A | Long-acting slump-retaining type polycarboxylic acid high-performance water reducer and preparation method thereof | 河南省楷澄新型材料有限公司 | 2024-09-10 | — | — | CN | claimed |
| CN-115155627-B | Multielement composite catalyst for preparing 1, 3-propanediol by hydrogenating methyl 3-hydroxypropionate and preparation method thereof | 中化泉州能源科技有限责任公司 | 2024-08-30 | — | — | CN | claimed |
| EP-0399929-A1 | Preparation of ultra high purity methyl acetate | EASTMAN KODAK COMPANY (US) | 1990-11-28 | — | — | EP | claimed |
| US-4939294-A | Preparation of ultra high purity methyl acetate | EASTMAN KODAK COMPANY (US) | 1990-07-03 | — | — | US | claimed |
| EP-0245902-A2 | Benzothiazinone derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-11-19 | — | — | EP | claimed |
| EP-0245901-A2 | Thiazinone derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-11-19 | — | — | EP | claimed |
| EP-0211667-A2 | Radiation-sensitive resin composition | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1987-02-25 | — | — | EP | claimed |
| US-4617405-A | REACTING ACID ANHYDRIDE WITH BETA-HYDROXY CARBONYL COMPOUND AND TREATING ESTER FORMED WITH BASIC CATALYST | A. E. STALEY MANUFACTURING COMPANY (US) | 1986-10-14 | — | — | US | claimed |
| US-4545812-A | HERBICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1985-10-08 | — | — | US | claimed |
| US-4435595-A | Reactive distillation process for the production of methyl acetate | EASTMAN KODAK COMPANY (US) | 1984-03-06 | — | — | US | claimed |
| US-4234718-A | METHANOL, CARBON MONOXIDE, ACETIC ANHYDRIDE, KETENE, METHYL ACETATE, ACETIC ACID | HALCON RESEARCH AND DEVELOPMENT CORP. (US) | 1980-11-18 | — | — | US | claimed |
| US-4140684-A | FOR POLYESTERS, POLYAMIDES, AND CELLULOSE ACETATES | FIDELITY UNION TRUST COMPANY, EXECUTIVE TRUSTEE UNDER THE SANDOZ TRUST (US) | 1979-02-20 | — | — | US | claimed |