⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16982376 | 1.00 | — | — | |
| SCHEMBL2423675 | 1.00 | — | — | |
| SCHEMBL16982378 | 1.00 | — | — | |
| SCHEMBL2424749 | 1.00 | — | — | |
| SCHEMBL2426317 | 0.81 | UGT2B7 (0.33) | — | |
| SCHEMBL2455721 | 0.81 | UGT2B7 (0.33) | — | |
| SCHEMBL1044707 | 0.76 | CYP17A1 (0.32) | — | |
| SCHEMBL14861768 | 0.74 | — | — | |
| SCHEMBL13747306 | 0.73 | — | — | |
| SCHEMBL7865608 | 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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023232234-A1 | ETHYL 2-CYCLOOCTYLACETATE AS A FRAGRANCE | SYMRISE AG (DE) | 2023-12-07 | — | — | WO | claimed |
| US-8445732-B2 | Organic compounds | GIVAUDAN SA (CH) | 2013-05-21 | — | — | US | claimed |
| EP-2252674-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-09-07 | — | — | EP | claimed |
| US-20100331427-A1 | Organic Compounds | GIVAUDAN SA (CH) | 2010-12-30 | — | — | US | claimed |
| EP-2252674-A1 | ORGANIC COMPOUNDS | Givaudan SA (CH) | 2010-11-24 | — | — | EP | claimed |
| WO-2009100554-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2009-08-20 | — | — | WO | claimed |
| US-20230151305-A1 | FRAGRANCE COMPOSITION | SA, GIVAUDAN (CH) | 2023-05-18 | — | — | US | disclosed |
| EP-4027968-A2 | NOVEL ORGANOLEPTIC COMPOUNDS | International Flavors and Fragrances Inc. (US) | 2022-07-20 | — | — | EP | disclosed |
| CN-103055341-B | Control agent of peculiar smell molecule | SHANGHAI OASIS AIRESTEC ENVIRONMENTAL PROT TECHNOLOGY CO LTD | 2015-03-11 | — | — | CN | disclosed |
| US-8445732-B2 | Organic compounds | GIVAUDAN SA (CH) | 2013-05-21 | — | — | US | disclosed |
| EP-2252674-B1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2011-09-07 | — | — | EP | disclosed |
| US-20100331427-A1 | Organic Compounds | GIVAUDAN SA (CH) | 2010-12-30 | — | — | US | disclosed |
| US-20100312018-A1 | Processes for Producing Levosandal and Levosandol | CANOS AVELINO CORMA | 2010-12-09 | — | — | US | disclosed |
| EP-2252674-A1 | ORGANIC COMPOUNDS | Givaudan SA (CH) | 2010-11-24 | — | — | EP | disclosed |
| EP-2236487-A2 | Processes for producing levosandal and levosandol | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2010-10-06 | — | — | EP | disclosed |
| EP-2099421-A1 | ANTIMICROBIAL FLAVOURING COMPOSITION | Firmenich SA (CH) | 2009-09-16 | — | — | EP | disclosed |
| WO-2009100554-A1 | ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2009-08-20 | — | — | WO | disclosed |
| WO-2008068683-A1 | ANTIMICROBIAL FLAVOURING COMPOSITION | FIRMENICH SA (CH) | 2008-06-12 | — | — | WO | disclosed |
| EP-1714637-A2 | Stable composition for hair dye comprising a fragrance | Takasago International Corporation (JP) | 2006-10-25 | — | — | EP | disclosed |