⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL99021 | 0.93 | — | — | |
| SCHEMBL21067333 | 0.93 | — | — | |
| SCHEMBL12216583 | 0.84 | CTSK (0.38) | — | |
| SCHEMBL10138778 | 0.84 | — | — | |
| SCHEMBL12216591 | 0.84 | CTSK (0.38) | — | |
| SCHEMBL2400021 | 0.83 | IDO1 (0.30) | — | |
| SCHEMBL7787843 | 0.82 | CTSK (0.40) | — | |
| SCHEMBL11449274 | 0.82 | CTSK (0.40) | — | |
| SCHEMBL12216588 | 0.82 | CTSK (0.40) | — | |
| Formic Acid SCHEMBL29446927 | 0.81 | ANPEP (0.34) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110217257-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-09-08 | — | — | US | claimed |
| EP-3707228-B1 | ALDEHYDIC ODORANT | FIRMENICH & CIE (CH) | 2024-09-11 | — | — | EP | disclosed |
| CN-111587284-B | Aldehyde odor agent | 弗门尼舍有限公司 | 2024-05-17 | — | — | CN | disclosed |
| US-11530367-B2 | Aldehydic odorant | FIRMENICH SA (CH) | 2022-12-20 | — | — | US | disclosed |
| US-20210095225-A1 | Aldehydic Odorant | FIRMENICH SA (CH) | 2021-04-01 | — | — | US | disclosed |
| EP-3707228-A1 | ALDEHYDIC ODORANT | Firmenich SA (CH) | 2020-09-16 | — | — | EP | disclosed |
| CN-111587284-A | Aldehyde odorant | 弗门尼舍有限公司 | 2020-08-25 | — | — | CN | disclosed |
| WO-2019185599-A1 | ALDEHYDIC ODORANT | FIRMENICH SA (CH) | 2019-10-03 | — | — | WO | disclosed |
| US-20110217257-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-09-08 | — | — | US | disclosed |
| US-20110217257-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-09-08 | — | — | US | disclosed |
| US-20110217257-A1 | NOVEL 4-ALKYL CYCLOHEXANEPROPANAL COMPOUNDS AND THEIR USE IN PERFUME COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. | 2011-09-08 | — | — | US | disclosed |