⚠ 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 SCHEMBL8519410 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL16336381 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL17760371 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL9069073 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL8068343 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL5014259 | 1.00 | — | — | |
| Acetonitrile SCHEMBL2782640 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL235806 | 1.00 | — | — | |
| Acetonitrile SCHEMBL20602258 | 1.00 | CA1 (0.40) | — | |
| Acetonitrile SCHEMBL15161756 | 1.00 | CA1 (0.40) | — |
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 10002 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-122084811-A | Construction method of traditional Chinese medicine compound preparation characteristic map for treating senile dementia | — | 2026-05-26 | — | — | CN | claimed |
| CN-121678900-B | Method for simultaneously detecting multiple amatoxins | Jinan Aixin Zhuoer medical laboratory Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-116735775-B | Method for detecting rosmarinic acid in selfheal seeds and selfheal seed oil and application thereof | Jiangxi Xinkangjian Technology Development Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-116735776-B | Method for simultaneously detecting isosorbide and rosmarinic acid in selfheal seeds and application of method | Jiangxi Xinkangjian Technology Development Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-122063212-A | Method for detecting genotoxic impurities in voronoi fumarate preparation | 深圳市中核海得威生物科技有限公司 | 2026-05-19 | — | — | CN | claimed |
| CN-122042840-A | Lipid oxidative metabolism characteristic analysis method and system based on REIMS and LC-MS/MS | 宁波市医疗中心李惠利医院(宁波大学附属李惠利医院) | 2026-05-15 | — | — | CN | claimed |
| CN-122017062-A | HPLC-MS/MS-based detection method for concentration of 8 two-wire antitubercular drugs | 杭州度安医学检验实验室有限公司 | 2026-05-12 | — | — | CN | claimed |
| CN-122005475-A | Preparation method of apricot Dan Ganwan and fingerprint spectrum method thereof | 河北锦坤动物药业有限公司 | 2026-05-12 | — | — | CN | claimed |
| CN-122017108-A | Construction method of traditional Chinese medicine compound preparation characteristic spectrum for Alzheimer disease | 五源本草(山东)健康科技有限公司 | 2026-05-12 | — | — | CN | claimed |
| CN-122017068-A | Bile acid high-flux detection method based on ultra-high performance liquid chromatography tandem mass spectrometry and application thereof | 青岛百谱生物科技有限公司 | 2026-05-12 | — | — | CN | claimed |
| US-5965752-A | Preparative scale isolation and purification of taxanes | INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) | 1999-10-12 | — | — | US | claimed |
| US-5858971-A | ANTIINFLAMMATORY, WOUND-HEALING, ANTI-ULCER AGENTS | SEKISUI CHEMICAL CO., LTD. (JP) | 1999-01-12 | — | — | US | claimed |
| WO-1998007712-A1 | PREPARATION SCALE ISOLATION AND PURIFICATION OF TAXANES | INSTITUTE ARMAND-FRAPPIER (CA) | 1998-02-26 | — | — | WO | claimed |
| US-5622779-A | Cellular factors that regulate the expression of genes encoding proteins involved in cholesterol homeostasis and methods of using same | SAN DIEGO STATE UNIVERSITY FOUNDATION (US) | 1997-04-22 | — | — | US | claimed |
| EP-0760670-A1 | CELLULAR FACTORS THAT REGULATE THE EXPRESSION OF GENES ENCODING PROTEINS INVOLVED IN CHOLESTEROL HOMEOSTASIS | San Diego State University Foundation (US) | 1997-03-12 | — | — | EP | claimed |
| WO-1995032721-A1 | CELLULAR FACTORS THAT REGULATE THE EXPRESSION OF GENES ENCODING PROTEINS INVOLVED IN CHOLESTEROL HOMEOSTASIS | SAN DIEGO STATE UNIVERSITY FOUNDATION (US) | 1995-12-07 | — | — | WO | claimed |
| EP-0010421-B1 | MIXTURE OF ANTIBIOTICS DESIGNATED BY A-21978, PROCESS FOR ITS PRODUCTION, THEIR PHARMACEUTICAL COMPOSITIONS AND PRODUCING MICROORGANISM | ELI LILLY AND COMPANY (US) | 1990-10-10 | — | — | EP | claimed |
| EP-0112604-A1 | Novel resolved keto compounds and process | ELI LILLY AND COMPANY (US) | 1984-07-04 | — | — | EP | claimed |
| US-4331594-A | PEPTIDE ANTIBIOTICS | ELI LILLY AND COMPANY (US) | 1982-05-25 | — | — | US | claimed |
| EP-0010421-A1 | Mixture of antibiotics designated by A-21978, process for its production, their pharmaceutical compositions and producing microorganism | ELI LILLY AND COMPANY (US) | 1980-04-30 | — | — | EP | claimed |