⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2029340 | 1.00 | — | — | |
| SCHEMBL380121 | 1.00 | — | — | |
| SCHEMBL4402822 | 0.75 | FFAR3 (0.46) | — | |
| SCHEMBL11026124 | 0.75 | LMNA (0.39) | — | |
| SCHEMBL18469390 | 0.75 | TSHR (0.46) | — | |
| SCHEMBL756363 | 0.75 | LMNA (0.39) | — | |
| Bicarbonate SCHEMBL11119225 | 0.75 | FFAR3 (0.46) | — | |
| SCHEMBL276990 | 0.75 | LMNA (0.39) | — | |
| SCHEMBL23923600 | 0.72 | — | — | |
| SCHEMBL4459656 | 0.72 | — | — |
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 491 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025108540-A1 | 5-METHYLCYCLOHEXANOLS AND DERIVATIVES AS FRAGRANCES | SYMRISE AG (DE) | 2025-05-30 | — | — | WO | claimed |
| CN-118949458-B | Preparation equipment and preparation process of 3-methyl-3-pentene-2-ketone | 浙江希尔化工股份有限公司 | 2025-02-11 | — | — | CN | claimed |
| CN-118949458-A | Preparation equipment and preparation process of 3-methyl-3-pentene-2-ketone | 浙江希尔化工股份有限公司 | 2024-11-15 | — | — | CN | claimed |
| CN-118290221-A | Method for extracting limonene from myrcene | 南平青华科技有限公司 | 2024-07-05 | — | — | CN | claimed |
| EP-4387947-A1 | PRODUCTION OF 4-HEXEN-3-ONE IN THE PRESENCE A ZINC COMPLEX CATALYST | International Flavors & Fragrances Inc. (US) | 2024-06-26 | — | — | EP | claimed |
| CN-114292174-B | Catalytic process for preparing 4-hexen-3-one | 国际香料和香精公司 | 2024-06-21 | — | — | CN | claimed |
| CN-116217365-B | Improved ambroxol synthesis method | 福州大学 | 2024-05-31 | — | — | CN | claimed |
| CN-116217365-A | Improved ambroxol synthesis method | 福州大学 | 2023-06-06 | — | — | CN | claimed |
| CN-115124411-B | Method for preparing 3-methyl-3-pentene-2-one | 新乡市博源生物科技有限公司 | 2023-04-07 | — | — | CN | claimed |
| WO-2023022758-A1 | PRODUCTION OF 4-HEXEN-3-ONE IN THE PRESENCE A ZINC COMPLEX CATALYST | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2023-02-23 | — | — | WO | claimed |
| EP-1914231-A2 | 2-Methyl-2-alkenyl-1,3-dioxanes as fragrances | Symrise GmbH & Co. KG (DE) | 2008-04-23 | — | — | EP | claimed |
| US-20080070825-A1 | 2-Methyl-2-alkenyl-substituted 1,3-dioxanes as odoriferous substances | SYMRISE GMBH & CO. KG (DE) | 2008-03-20 | — | — | US | claimed |
| EP-1238962-B1 | A process for the preparation of michael-adducts | FIRMENICH & CIE (CH) | 2008-02-27 | — | — | EP | claimed |
| US-6943272-B2 | Norbornane and norbornene derivatives, use thereof and perfumed products containing same | V. MANE FILS (FR) | 2005-09-13 | — | — | US | claimed |
| US-6686498-B2 | REACTING AN ALPHA, BETA-DISUBSTITUTED, OR AN ALPHA, BETA, BETA-TRISUBSTITUTED, ALPHA, BETA-UNSATURATED KETONE WITH A BETA-KETOESTER OR A BETA-DIKETONE; COUPLING; BYPRODUCT INHIBITION | FIRMENICH SA (CH) | 2004-02-03 | — | — | US | claimed |
| JP-2002544245-A | — | — | 2002-12-24 | — | — | JP | claimed |
| US-20020128504-A1 | Process for the preparation of Michael-adducts | FIRMENICH SA (CH) | 2002-09-12 | — | — | US | claimed |
| EP-1238962-A1 | A process for the preparation of michael-adducts | FIRMENICH SA (CH) | 2002-09-11 | — | — | EP | claimed |
| EP-1178945-A1 | REACTIONS USING LEWIS ACIDS | QUEST INTERNATIONAL B.V. (NL) | 2002-02-13 | — | — | EP | claimed |
| WO-2000069777-A1 | REACTIONS USING LEWIS ACIDS | QUEST INTERNATIONAL B.V. (NL) | 2000-11-23 | — | — | WO | claimed |