⚠ 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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL7547889 | 1.00 | TP53 (0.93) | — | |
| Ethylbenzene SCHEMBL10592575 | 0.97 | TP53 (0.88) | — | |
| Ethylbenzene SCHEMBL246705 | 0.97 | TP53 (0.88) | — | |
| Ethylbenzene SCHEMBL11703785 | 0.97 | TP53 (0.88) | — | |
| Ethylbenzene SCHEMBL27455702 | 0.97 | TP53 (0.88) | — | |
| Ethylbenzene SCHEMBL25237466 | 0.97 | TP53 (0.88) | — | |
| Ethylbenzene SCHEMBL11223212 | 0.97 | TP53 (1.00) | — | |
| Ethylbenzene SCHEMBL3987542 | 0.97 | TP53 (1.00) | — | |
| Ethylbenzene SCHEMBL7458207 | 0.97 | TP53 (1.00) | — | |
| Ethylbenzene SCHEMBL1332452 | 0.97 | — | — |
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 3295 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-120136773-A | Preparation method of 3, 5-difluoropiperidine and derivatives thereof | 艾琪康医药科技（上海）有限公司 | 2025-06-13 | — | — | CN | claimed |
| CN-120059313-A | Preparation method and application of fast neutron scintillation screen | 太原科技大学 | 2025-05-30 | — | — | CN | claimed |
| CN-119912453-A | Perylene bisimide photo-thermal diagnosis and treatment agent, preparation method thereof and product containing perylene bisimide photo-thermal diagnosis and treatment agent | 福建师范大学 | 2025-05-02 | — | — | CN | claimed |
| CN-115616100-B | Method for simultaneously detecting multiple biogenic amines in food by adopting high performance liquid chromatography | 广东珠江桥生物科技股份有限公司 | 2025-04-29 | — | — | CN | claimed |
| CN-119822969-A | Method for continuously preparing 4-nitrophenethylamine and salt thereof | 浙江华海药业股份有限公司 | 2025-04-15 | — | — | CN | claimed |
| CN-119656869-A | Method for realizing diastereomeric crystallization mother liquor regeneration and reuse of amine chiral compound by utilizing unconventional electrodialysis | 湖南科技大学 | 2025-03-21 | — | — | CN | claimed |
| CN-119614183-A | Preparation method of surface-passivated red perovskite quantum dot | 浙江工业大学 | 2025-03-14 | — | — | CN | claimed |
| CN-119505235-A | Preparation and application of dual-function low-temperature demulsifier prepared by polysuccinimide modification | 贵州民族大学 | 2025-02-25 | — | — | CN | claimed |
| CN-116496150-B | Preparation method of 2, 7-dimethyl-2, 4, 6-octatriene-1, 8-dialdehyde | 万华化学集团股份有限公司 | 2025-02-18 | — | — | CN | claimed |
| CN-117757784-B | Enzyme and cofactor co-immobilized millimeter sphere catalyst and preparation and application thereof | 山西大学 | 2025-01-28 | — | — | CN | claimed |
| EP-0101570-B1 | METHOD FOR THE RESOLUTION OF RACEMIC 2-CP-DIFLUOROMETHOXY PHENYL)-3-METHYLBUTYRIC ACID | AMERICAN CYANAMID COMPANY (US) | 1988-01-27 | — | — | EP | claimed |
| US-4683089-A | SEPARATION OF OPTICAL ISOMERS, INSECTICIDES | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1987-07-28 | — | — | US | claimed |
| WO-1987004161-A1 | DIASTEREOMERS OF 10-ALKYL-10-DIAZAMINOPTERINS AND PROCESS FOR PREPARING THE SAME | SRI INTERNATIONAL (US) | 1987-07-16 | — | — | WO | claimed |
| US-4454344-A | Method for the resolution of racemic 2-(p-difluoromethoxyphenyl)-3-methylbutyric acid | AMERICAN CYANAMID COMPANY (US) | 1984-06-12 | — | — | US | claimed |
| EP-0101570-A1 | Method for the resolution of racemic 2-CP-difluoromethoxy phenyl)-3-methylbutyric acid | AMERICAN CYANAMID COMPANY (US) | 1984-02-29 | — | — | EP | claimed |
| EP-0010874-B1 | PROCESS FOR SEPARATING OPTICAL ISOMERS OF SUBSTITUTED CYCLOPROPANE CARBOXYLIC ACIDS; AMINE SALTS OF SUBSTITUTED CYCLOPROPANE CARBOXYLIC ACIDS; A SUBSTITUTED CYCLOPROPANE CARBOXYLIC ACID | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-06-22 | — | — | EP | claimed |
| EP-0006608-B1 | HERBICIDAL, OPTICALLY ACTIVE R(+)-DICHLOROPYRIDYLOXY-ALPHA-PHENOXY-PROPIONIC ACID-PROPARGYLESTERS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN HERBICIDAL COMPOSITIONS | CIBA-GEIGY AG (CH) | 1982-06-30 | — | — | EP | claimed |
| EP-0010874-A1 | Process for separating optical isomers of substituted cyclopropane carboxylic acids; amine salts of substituted cyclopropane carboxylic acids; a substituted cyclopropane carboxylic acid | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-05-14 | — | — | EP | claimed |
| US-4066567-A | LIQUID CRYSTAL CUMULATIVE DOSIMETER | TEMPLE UNIVERSITY (US) | 1978-01-03 | — | — | US | claimed |
| US-4014895-A | Method for synthesis of optically active thiolactones | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-03-29 | — | — | US | claimed |