⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4436993 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL4425883 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL5181360 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL4424265 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL5181161 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL23037444 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL4424172 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL7607320 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL3186133 | 0.98 | TRPA1 (0.61) | — | |
| SCHEMBL5180317 | 0.98 | TRPA1 (0.61) | — |
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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017136344-A1 | PROCESS FOR PRODUCING C7 COMPOUNDS STARTING FROM 9-HYDROPEROXIDIZED LINOLEIC ACID | INVISTA North America S.à.r.l. (US) | 2017-08-10 | — | — | WO | claimed |
| CN-103819335-B | A kind of preparation method of 2,6-dimethyl-6-alkoxyl group (or hydroxyl) enanthaldehyde | NANJING YUNHUA LITAI ENERGY SCIENCE & TECHNOLOGY CO., LTD. (CN) | 2016-01-20 | — | — | CN | claimed |
| EP-0706509-B1 | SHORT CHAIN 2-HYDROXYCARBOXYLIC ACID-BASED DERIVATIVES OF CERAMIDES | DSM NV (NL) | 2000-01-05 | — | — | EP | claimed |
| EP-4663736-A1 | DETERGENT FOR STRENGTHENING TEXTILE STRUCTURE | Henkel AG & Co. KGaA (DE) | 2025-12-17 | — | — | EP | disclosed |
| EP-4663735-A1 | DETERGENT FOR STRENGTHENING TEXTILE STRUCTURE | Henkel AG & Co. KGaA (DE) | 2025-12-17 | — | — | EP | disclosed |
| US-20250376640-A1 | DETERGENT FOR STRENGTHENING TEXTILE STRUCTURE | HENKEL AG & CO KGAA (DE) | 2025-12-11 | — | — | US | disclosed |
| WO-2025214662-A1 | HAIR CARE SHAMPOO CONTAINING POLYLYSINE | HENKEL AG & CO. KGAA (DE) | 2025-10-16 | — | — | WO | disclosed |
| WO-2025108627-A1 | TRANSFORMING HAIR TREATMENT PRODUCT | HENKEL AG & CO. KGAA (DE) | 2025-05-30 | — | — | WO | disclosed |
| WO-2025056266-A1 | METHOD FOR REPAIRING HAIR DAMAGE AND FOR STRENGTHENING INNER HAIR STRUCTURE | HENKEL AG & CO. KGAA (DE) | 2025-03-20 | — | — | WO | disclosed |
| CN-112442272-B | Maleimide resin film and composition for maleimide resin film | 信越化学工业株式会社 | 2024-06-25 | — | — | CN | disclosed |
| CN-116768715-A | Beta-hydroxyaldehyde compound and preparation method thereof | 国药集团化学试剂有限公司 | 2023-09-19 | — | — | CN | disclosed |
| EP-0906108-A1 | METHOD OF TREATING HEART FAILURE WITH ENDOTHELIN ANTAGONISTS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1999-04-07 | — | — | EP | disclosed |
| US-5834483-A | Method of treating heart failure with endothelin antagonists | MERCK & CO., INC. (US) | 1998-11-10 | — | — | US | disclosed |
| US-5714479-A | TREATMENT OF HYPERTENSION, ACUTE RENAL FAILURE, ANGINA PECTORIS, ARTERIOSCLEROSIS, ASTHMA, GASTRIC ULCER AND SIMILAR AILMENTS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-02-03 | — | — | US | disclosed |
| WO-1997037665-A1 | METHOD OF TREATING HEART FAILURE WITH ENDOTHELIN ANTAGONISTS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1997-10-16 | — | — | WO | disclosed |
| US-5599959-A | FOR IMPROVING BLOOD FLOW AND ELASTICITY OF ERYTHROCYTES | UNIVERSITY OF MARYLAND (US) | 1997-02-04 | — | — | US | disclosed |
| CN-1129448-A | Fused heteroaromatic cyclopentene derivative having endothelin-antagonist activity | BANYU PHARMA CO LTD (JP) | 1996-08-21 | — | — | CN | disclosed |
| EP-0714897-A1 | FUSED HETEROAROMATIC CYCLOPENTENE DERIVATIVE HAVING ENDOTHELIN-ANTAGONIST ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-06-05 | — | — | EP | disclosed |
| CN-86108415-A | Novel isoindoline derivative and preparation method thereof | — | 1987-08-19 | — | — | CN | disclosed |
| US-3957745-A | FLAVORING AND FRAGRANCE COMPOSITIONS | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-05-18 | — | — | US | disclosed |