⚠ 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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL8467273 | 1.00 | — | — | |
| Acetonitrile SCHEMBL15051448 | 1.00 | — | — | |
| Acetonitrile SCHEMBL2259244 | 1.00 | — | — | |
| Acetonitrile SCHEMBL18187251 | 0.95 | — | — | |
| Acetonitrile SCHEMBL310845 | 0.95 | — | — | |
| Acetonitrile SCHEMBL10594717 | 0.95 | — | — | |
| Acetonitrile SCHEMBL2812301 | 0.95 | — | — | |
| Acetonitrile SCHEMBL528219 | 0.95 | — | — | |
| Acetonitrile SCHEMBL20586623 | 0.95 | — | — | |
| Acetonitrile SCHEMBL21250174 | 0.95 | — | — |
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 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118880384-A | Method for preparing electrocatalyst by using cadmium-containing wastewater, electrocatalyst-containing working electrode and application of electrocatalyst-containing working electrode | 中国华能集团清洁能源技术研究院有限公司 | 2024-11-01 | — | — | CN | claimed |
| CN-118308437-A | Method for dynamically and dynamically splitting chiral compound by copper and lipase synergistic catalysis shaft | 复旦大学 | 2024-07-09 | — | — | CN | claimed |
| CN-113557275-B | Two-part curable composition | 博斯蒂克股份公司 | 2024-04-02 | — | — | CN | claimed |
| CN-117624260-A | 2-deoxy-2-trifluoromethyl substituted glycosyl o-alkynyl benzoate compound, preparation method and application thereof | 国科大杭州高等研究院 | 2024-03-01 | — | — | CN | claimed |
| CN-117466717-A | Fully substituted alkyl alkenyl ether, preparation method and application | 四川大学 | 2024-01-30 | — | — | CN | claimed |
| CN-114031615-B | Hydroxy-substituted pyridine oxazoline ligands and their use in hydrohalogenation of olefins | 中国科学院上海有机化学研究所 | 2023-09-19 | — | — | CN | claimed |
| CN-112321627-B | Axis chiral arylethynyl silane compound and preparation method thereof | 杭州师范大学 | 2023-09-01 | — | — | CN | claimed |
| CN-114249682-B | 1, 2-glycol ester compound and preparation method thereof | 中国科学院上海有机化学研究所 | 2023-07-07 | — | — | CN | claimed |
| CN-111647018-B | Preparation method of phosphorus center chiral compound | 杭州师范大学 | 2023-04-07 | — | — | CN | claimed |
| CN-115385974-A | Method for synthesizing On-DNA aryl alkyne lead compound | 康龙化成(宁波)科技发展有限公司 | 2022-11-25 | — | — | CN | claimed |
| CN-113173939-B | Method for synthesizing tri-substituted alkenyl borate through copper-catalyzed three-component reaction | 常州大学 | 2022-07-05 | — | — | CN | claimed |
| CN-113072456-B | Chiral alpha-difluoromethyl amino acid compound and preparation method thereof | 中国科学技术大学 | 2022-04-19 | — | — | CN | claimed |
| CN-114195842-A | Terminal alkynyl deoxyribonucleic acid and self-coupling method thereof | 康龙化成(宁波)科技发展有限公司 | 2022-03-18 | — | — | CN | claimed |
| CN-113754674-A | Method for synthesizing natural products Pannoncatinine B and C | 华中科技大学 | 2021-12-07 | — | — | CN | claimed |
| CN-113735916-A | Method for converting terminal alkyne into amide and application of method in construction of gene coding library | 康龙化成(宁波)科技发展有限公司 | 2021-12-03 | — | — | CN | claimed |
| CN-113698441-A | Method for converting terminal alkyne into carboxylic acid and application of method in construction of gene coding library | 康龙化成(宁波)科技发展有限公司 | 2021-11-26 | — | — | CN | claimed |
| CN-113511991-A | Synthesis method for thioatherification and thiocarbonylation of halogenated alkane | 安徽农业大学 | 2021-10-19 | — | — | CN | claimed |
| CN-109400508-A | The method that the asymmetric big steric hindrance imines of palladium catalyzed hydrogenation Z formula prepares big steric hindrance Chiral Amine | 上海交通大学 | 2019-03-01 | — | — | CN | claimed |
| CN-119490660-B | Organic silicon elastomer capable of self-repairing at room temperature, preparation method and metal coordination organic silicon elastomer | 北京化工大学 | 2026-02-27 | — | — | CN | disclosed |
| EP-0253310-A2 | Angiotensin II receptor blocking imidazoles | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-01-20 | — | — | EP | disclosed |