⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9629778 | 0.80 | — | — | |
| Styrene SCHEMBL16875725 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL19069245 | 0.78 | — | — | |
| SCHEMBL9628964 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL379143 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL9630938 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL10868575 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL9628957 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL11720449 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL10024721 | 0.76 | TSHR (0.42) | — |
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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12344569-B2 | Process for making a conjugated diene from an allyl alcohol | GIVAUDAN SA (CH) | 2025-07-01 | — | — | US | claimed |
| EP-4168383-B1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2024-07-31 | — | — | EP | claimed |
| US-20230322645-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2023-10-12 | — | — | US | claimed |
| EP-4168383-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | Givaudan SA (CH) | 2023-04-26 | — | — | EP | claimed |
| CN-115996904-A | Process for preparing conjugated dienes from allyl alcohol | 奇华顿股份有限公司 | 2023-04-21 | — | — | CN | claimed |
| WO-2021255052-A1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2021-12-23 | — | — | WO | claimed |
| US-8999914-B2 | Cyclohexene- and cyclopropanated cyclohexene- derivatives as fragrances | GIVAUDAN S.A. (CH) | 2015-04-07 | — | — | US | claimed |
| EP-2603483-B1 | CYCLOHEXENE- AND CYCLOPROPANATED CYCLOHEXENE- DERIVATIVES AS FRAGRANCES | GIVAUDAN SA (CH) | 2015-02-25 | — | — | EP | claimed |
| US-20130303433-A1 | Cyclohexene- And Cyclopropanated Cyclohexene- Derivatives As Fragrances | GIVAUDAN S.A. (CH) | 2013-11-14 | — | — | US | claimed |
| EP-2603483-A1 | CYCLOHEXENE- AND CYCLOPROPANATED CYCLOHEXENE - DERIVATIVES AS FRAGRANCES | Givaudan SA (CH) | 2013-06-19 | — | — | EP | claimed |
| WO-2012020076-A1 | CYCLOHEXENE- AND CYCLOPROPANATED CYCLOHEXENE - DERIVATIVES AS FRAGRANCES | GIVAUDAN SA (CH) | 2012-02-16 | — | — | WO | claimed |
| US-12344569-B2 | Process for making a conjugated diene from an allyl alcohol | GIVAUDAN SA (CH) | 2025-07-01 | — | — | US | disclosed |
| WO-2025028599-A1 | METHOD FOR PRODUCING 1,2-POLYBUTADIENE AND CATALYST COMPOSITION | 株式会社ＥＮＥＯＳマテリアル | 2025-02-06 | — | — | WO | disclosed |
| EP-4168383-B1 | PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL | GIVAUDAN SA (CH) | 2024-07-31 | — | — | EP | disclosed |
| EP-3702404-B1 | POLYMER COMPOSITION AND TIRE | ENEOS MAT CORPORATION (JP) | 2024-07-17 | — | — | EP | disclosed |
| EP-1369454-A1 | OIL EXTENDED 1, 2-POLYBUTADIENE AND METHOD OF MANUFACTURING THE POLYBUTADIENE, AND COMPOSITION AND FORMED PRODUCT THEREOF | JSR Corporation (JP) | 2003-12-10 | — | — | EP | disclosed |
| CN-1454221-A | 1, 2-polybutadiene, thermoplastic elastomer composition and polymer composition | JSR CORP (JP) | 2003-11-05 | — | — | CN | disclosed |
| EP-1306396-A1 | 1,2-POLYBUTADIENE, THERMOPLASTIC ELASTOMER COMPOSITION AND POLYMER COMPOSITION | JSR Corporation (JP) | 2003-05-02 | — | — | EP | disclosed |
| WO-2001058912-A1 | DINUCLEAR GROUP 4 METAL BORON OR ALUMINUM BRIDGE CONTAINING ANSA-COMPLEXES | THE DOW CHEMICAL COMPANY (US) | 2001-08-16 | — | — | WO | disclosed |
| US-4985471-A | HYDROGENATED BUTADIENE OLIGOMERS, CHAIN TRANSFER AGENT, POLYMERIZATION INHIBITOR | HITACHI CHEMICAL COMPANY LTD. (JP) | 1991-01-15 | — | — | US | disclosed |