⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9179241 | 0.77 | — | — | |
| SCHEMBL28418126 | 0.75 | — | — | |
| SCHEMBL22009322 | 0.70 | — | — | |
| SCHEMBL1568783 | 0.69 | MEN1 (0.32) | — | |
| Acetaldehyde SCHEMBL11445865 | 0.68 | — | — | |
| SCHEMBL12288881 | 0.68 | PTPN1 (0.40) | — | |
| SCHEMBL20529714 | 0.68 | — | — | |
| SCHEMBL20529716 | 0.68 | NPC1 (0.30) | — | |
| SCHEMBL28281199 | 0.65 | — | — | |
| SCHEMBL826525 | 0.64 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4536622-A1 | PROCESS FOR THE INTRACYCLIC DOUBLE BOND ISOMERIZATION | Firmenich SA (CH) | 2025-04-16 | — | — | EP | claimed |
| WO-2023237600-A1 | PROCESS FOR THE INTRACYCLIC DOUBLE BOND ISOMERIZATION | FIRMENICH SA (CH) | 2023-12-14 | — | — | WO | claimed |
| EP-4536622-A1 | PROCESS FOR THE INTRACYCLIC DOUBLE BOND ISOMERIZATION | Firmenich SA (CH) | 2025-04-16 | — | — | EP | disclosed |
| WO-2023237600-A1 | PROCESS FOR THE INTRACYCLIC DOUBLE BOND ISOMERIZATION | FIRMENICH SA (CH) | 2023-12-14 | — | — | WO | disclosed |
| EP-3233820-A1 | NOVEL ACETALS OF 1-(3,3-DIMETHYLCYCLOHEX-1-ENYL) ETHANONE, METHOD FOR THE PRODUCTION THEREOF AND USE OF SAME IN PERFUMERY | V. Mane Fils (FR) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016097569-A1 | NOVEL ACETALS OF 1-(3,3-DIMETHYLCYCLOHEX-1-ENYL) ETHANONE, METHOD FOR THE PRODUCTION THEREOF AND USE OF SAME IN PERFUMERY | V. MANE FILS (FR) | 2016-06-23 | — | — | WO | disclosed |
| EP-2566838-A1 | COMPOUNDS WITH A WOODY NOTE | V. Mane Fils (FR) | 2013-03-13 | — | — | EP | disclosed |
| WO-2011138747-A1 | COMPOUNDS WITH A WOODY NOTE | V. MANE FILS (FR) | 2011-11-10 | — | — | WO | disclosed |