⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL17800994 | 1.00 | — | — | |
| Acetic Acid SCHEMBL8752671 | 0.87 | FFAR3 (0.35) | — | |
| SCHEMBL3341220 | 0.81 | — | — | |
| Dimethylformamide SCHEMBL8084521 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL2973761 | 0.80 | — | — | |
| Methyl Alcohol SCHEMBL4608132 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL5590844 | 0.73 | — | — | |
| SCHEMBL16889132 | 0.73 | — | — | |
| SCHEMBL3499736 | 0.73 | — | — | |
| SCHEMBL16889133 | 0.73 | — | — |
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 535 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115851685-B | Nitrilase and application thereof in synthesis of 3-hydroxy-3-methylbutyric acid | 万华化学集团股份有限公司 | 2025-04-01 | — | — | CN | claimed |
| US-12162828-B2 | Process for preparing 3-hydroxy-3-methylbutyric acid (HMB) and salts thereof | EVONIK OPERATIONS GMBH (DE) | 2024-12-10 | — | — | US | claimed |
| CN-118348146-A | HPLC detection method for migration amount of simethicone in medicine | 南京臣功制药股份有限公司 | 2024-07-16 | — | — | CN | claimed |
| CN-117420245-A | Detection method of human dry blood spot ceramide and kit for detecting ceramide | 南京品生医学检验实验室有限公司 | 2024-01-19 | — | — | CN | claimed |
| CN-117088911-A | Method for separating PE from breast milk extracellular vesicles and application of PE in preparation of medicines for preventing and treating obesity | 上海市同仁医院 | 2023-11-21 | — | — | CN | claimed |
| CN-117030871-A | Method for detecting palmitic acid in paliperidone palmitate | 济南辰欣医药科技有限公司 | 2023-11-10 | — | — | CN | claimed |
| CN-114561210-B | Zn-Cu-In-S quantum sheet, solar cell, and preparation method and application thereof | 青岛大学 | 2023-10-13 | — | — | CN | claimed |
| US-20230312486-A1 | POLYMORPHIC FORMS OF A ROR INHIBITING COMPOUND AND PROCESSES FOR ITS PREPARATION | GLENMARK SPECIALTY S.A. (CH) | 2023-10-05 | — | — | US | claimed |
| CN-116688563-A | Composite extractant, pretreatment method for detecting estrone in blood and detection method for detecting estrone in blood | 浙江省疾病预防控制中心 | 2023-09-05 | — | — | CN | claimed |
| CN-116500180-A | LC-MS/MS-based ceramide chromatographic characteristic prediction and characterization method | 上海大学 | 2023-07-28 | — | — | CN | claimed |
| WO-2015052568-A2 | SOLID FORMS OF CURCUMIN AND DERIVATIVES THEREOF | LAURUS LABS PRIVATE LIMITED (IN) | 2015-04-16 | — | — | WO | claimed |
| US-20040142946-A1 | Modified nucleosides and nucleotides and use thereof | CHATTOPADHYAYA JYOTI (SE) | 2004-07-22 | — | — | US | claimed |
| EP-1332150-A1 | MODIFIED NUCLEOSIDES AND NUCLEOTIDES AND USE THEREOF | Chattopadhyaya, Jyoti (SE) | 2003-08-06 | — | — | EP | claimed |
| WO-2002038578-A1 | MODIFIED NUCLEOSIDES AND NUCLEOTIDES AND USE THEREOF | CHATTOPADHYAYA JYOTI (SE) | 2002-05-16 | — | — | WO | claimed |
| US-6022977-A | Dynamic resolution of isoxazoline thioesters to isoxazoline carboxylic acids | DUPONT PHARMACEUTICALS COMPANY (US) | 2000-02-08 | — | — | US | claimed |
| EP-0971906-A1 | LIPASE CATALYZED DYNAMIC RESOLUTION OF ISOXAZOLINE THIOESTERS TO ISOXAZOLINE CARBOXYLIC ACIDS | Du Pont Pharmaceuticals Company (US) | 2000-01-19 | — | — | EP | claimed |
| WO-1998042687-A1 | LIPASE CATALYZED DYNAMIC RESOLUTION OF ISOXAZOLINE THIOESTERS TO ISOXAZOLINE CARBOXYLIC ACIDS | DU PONT PHARMACEUTICALS COMPANY (US) | 1998-10-01 | — | — | WO | claimed |
| US-5721350-A | Deuterated nucleosides | CHATTOPADHYAYA JYOTI (SE) | 1998-02-24 | — | — | US | claimed |
| EP-0648220-A1 | DEUTERATED NUCLEOSIDES | CHATTOPADHYAYA, Jyoti (SE) | 1995-04-19 | — | — | EP | claimed |
| WO-1993025566-A1 | DEUTERATED NUCLEOSIDES | CHATTOPADHYAYA JYOTI (SE) | 1993-12-23 | — | — | WO | claimed |