⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1783966 | 1.00 | — | — | |
| SCHEMBL6925729 | 1.00 | — | — | |
| SCHEMBL12845021 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL19055097 | 0.79 | — | — | |
| SCHEMBL11452438 | 0.75 | — | — | |
| SCHEMBL9609508 | 0.75 | — | — | |
| SCHEMBL10526392 | 0.75 | — | — | |
| SCHEMBL10526397 | 0.75 | — | — | |
| SCHEMBL1785939 | 0.75 | — | — | |
| SCHEMBL1785941 | 0.75 | — | — |
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 74 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102942460-B | Unsaturated acetal preparation method | WANHUA CHEMICAL GROUP CO LTD | 2014-09-17 | — | — | CN | claimed |
| CN-102462690-B | Application of 3,8,12,14,17,20-position oxygen-substituted pregnene glycoside compound in preparing medicine for appetite inhibition | SHANGHAI INST MATERIA MEDICA | 2013-04-17 | — | — | CN | claimed |
| CN-102942460-A | Unsaturated acetal preparation method | YANTAI WANHUA POLYURETHANES CO | 2013-02-27 | — | — | CN | claimed |
| CN-1239454-C | Method for continuous preparing aldehyde acetal | BASF AG (DE) | 2006-02-01 | — | — | CN | claimed |
| EP-1186589-B1 | Continuous process for the production of acetals | BASF AG (DE) | 2003-11-05 | — | — | EP | claimed |
| US-6518464-B2 | Reacting an unsaturated compound with allyl alcohol | BASF AKTIENGESELLSCHAFT (DE) | 2003-02-11 | — | — | US | claimed |
| CN-1342635-A | Method for continuous preparing aldehyde acetal | BASF AG (DE) | 2002-04-03 | — | — | CN | claimed |
| US-20020035298-A1 | Continuous process for the preparation of acetals | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-21 | — | — | US | claimed |
| EP-1186589-A1 | Continuous process for the production of acetals | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-13 | — | — | EP | claimed |
| US-4021411-A | Production of high molecular weight α,β-unsaturated aldehydes | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-05-03 | — | — | US | claimed |
| WO-2025059040-A1 | MUTANT KRAS MODULATORS AND USES THEREOF | NEWAVE PHARMACEUTICAL INC. (US) | 2025-03-20 | — | — | WO | disclosed |
| CN-112004805-B | Process for producing 5, 5-disubstituted-4, 5-dihydroisoxazoles | 组合化学工业株式会社 | 2024-06-14 | — | — | CN | disclosed |
| WO-2024029475-A1 | WAVELENGTH CONVERSION FILM FORMING COMPOSITION | 日産化学株式会社 | 2024-02-08 | — | — | WO | disclosed |
| CN-115197051-B | Compound and preparation method and application thereof | 中国药科大学 | 2023-11-03 | — | — | CN | disclosed |
| US-11753384-B2 | Production method for 5,5-di-substituted-4,5-dihydroisoxazole | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2023-09-12 | — | — | US | disclosed |
| EP-0577042-A1 | Hydroformylation process for producing 1,6-hexanedials | UNION CARBIDE COATINGS SERVICE TECHNOLOGY CORP. (US) | 1994-01-05 | — | — | EP | disclosed |
| US-4133836-A | UNSATURATED ALDEHYDE AND ALCOHOL, NITRIC ACID, RECTIFICATION | BASF AKTIENGESELLSCHAFT (DE) | 1979-01-09 | — | — | US | disclosed |
| US-4058536-A | Production of high molecular weight α,β-unsaturated aldehydes | BASF AKTIENGESELLSCHAFT (DT) | 1977-11-15 | — | — | US | disclosed |
| US-4021411-A | Production of high molecular weight α,β-unsaturated aldehydes | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-05-03 | — | — | US | disclosed |
| US-3965193-A | Production of high molecular weight α,β-unsaturated aldehydes | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1976-06-22 | — | — | US | disclosed |