⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16845288 | 1.00 | — | — | |
| SCHEMBL28247921 | 0.97 | — | — | |
| SCHEMBL28147680 | 0.97 | — | — | |
| SCHEMBL27300910 | 0.97 | — | — | |
| SCHEMBL28628309 | 0.92 | AKR1B1 (0.42) | — | |
| Piperazine SCHEMBL2044442 | 0.86 | AKR1B1 (0.37) | — | |
| Hydroxyl Radical SCHEMBL5311315 | 0.83 | — | — | |
| SCHEMBL830089 | 0.83 | — | — | |
| SCHEMBL13250428 | 0.83 | — | — | |
| SCHEMBL28064890 | 0.83 | — | — |
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 213 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120054398-A | Multistage cyanidation reaction system and method | 重庆鑫富化工有限公司 | 2025-05-30 | — | — | CN | claimed |
| US-20250122137-A1 | METHOD FOR PREPARING 1,2-PENTANEDIOL | Zhejiang Boju New Materials Co., Ltd. (CN) | 2025-04-17 | — | — | US | claimed |
| CN-119753039-A | 1, 2-Pentanediol biosynthesis method and recombinant microorganism for producing 1, 2-pentanediol | 上海锐康生物技术研发有限公司 | 2025-04-04 | — | — | CN | claimed |
| CN-117384011-A | Preparation method of 1, 2-pentanediol | 浙江博聚新材料有限公司 | 2024-01-12 | — | — | CN | claimed |
| CN-113121308-A | Method for synthesizing neopentyl glycol by catalytic hydrogenation of hydroxypentanal | 云南恒罡科技有限公司 | 2021-07-16 | — | — | CN | claimed |
| CN-112358378-A | Neopentyl glycol synthesis method | 宁夏宁顺新材料科技有限公司 | 2021-02-12 | — | — | CN | claimed |
| CN-105189426-B | Integrated process for the simultaneous production of oxo-alcohols and plasticizers | 沙特基础工业公司 | 2020-09-18 | — | — | CN | claimed |
| CN-111574351-A | Long-wavelength hydroxymethyl phenyl ketone photoinitiator and preparation method thereof | 北京化工大学常州先进材料研究院 | 2020-08-25 | — | — | CN | claimed |
| CN-101977883-A | Process for production of 2-hydroxyaryl aldehyde compound | NISSAN CHEMICAL IND LTD | 2011-02-16 | — | — | CN | claimed |
| EP-1511500-A4 | COMBINATION OF ANTI-MUSCARINIC AGENTS AND NON-GLUCOCORTICOID STEROIDS | EPIGENESIS PHARMACEUTICALS LLC (US) | 2009-04-29 | — | — | EP | claimed |
| US-6025347-A | Steroid esters useful against skin disorders | ESTEE LAUDER INC. (US) | 2000-02-15 | — | — | US | claimed |
| EP-0706509-B1 | SHORT CHAIN 2-HYDROXYCARBOXYLIC ACID-BASED DERIVATIVES OF CERAMIDES | DSM NV (NL) | 2000-01-05 | — | — | EP | claimed |
| US-5948418-A | MERCAPTANS | ESTEE LAUDER, INC. (US) | 1999-09-07 | — | — | US | claimed |
| WO-1999006017-A1 | PERFUME COMPOSITION USING ORGANOPOLYSILOXANES | RHODIA CHIMIE (FR) | 1999-02-11 | — | — | WO | claimed |
| EP-0876391-A4 | NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS | ESTEE LAUDER INC (US) | 1998-12-30 | — | — | EP | claimed |
| EP-0876391-A1 | NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS | ESTEE LAUDER INC. (US) | 1998-11-11 | — | — | EP | claimed |
| CN-1037509-C | Process for the preparation of ortho-hydroxy substituted aromatic nitriles via dehydration of the corresponding aldoximes | ZENECA LTD (GB) | 1998-02-25 | — | — | CN | claimed |
| US-5683705-A | Sulfur-based amides and bis-amides useful against skin disorders | ESTEE LAUDER, INC. (US) | 1997-11-04 | — | — | US | claimed |
| WO-1997010255-A1 | NOVEL STEROID ESTERS USEFUL AGAINST SKIN DISORDERS | ESTEE LAUDER, INC. (US) | 1997-03-20 | — | — | WO | claimed |
| CN-1118161-A | Method for producing ortho-hydroxy-substituted aromatic nitriles by dehydration of the corresponding aldoximes | ZENECA LTD (GB) | 1996-03-06 | — | — | CN | claimed |