⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2585972 | 1.00 | — | — | |
| SCHEMBL112059 | 0.86 | MEN1 (0.33) | — | |
| SCHEMBL7776198 | 0.82 | — | — | |
| SCHEMBL7776196 | 0.82 | — | — | |
| SCHEMBL11369860 | 0.81 | MEN1 (0.36) | — | |
| SCHEMBL11374411 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL14845011 | 0.76 | CYP4F2 (0.33) | — | |
| SCHEMBL14844387 | 0.75 | — | — | |
| SCHEMBL11374009 | 0.72 | — | — | |
| SCHEMBL28347234 | 0.72 | FNTA (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4147672-A | Cyclic C6 ketones in perfumes | FIRMENICH SA (CH) | 1979-04-03 | — | — | US | claimed |
| US-9085516-B2 | Compounds with a woody note | V. MANE FILS (FR) | 2015-07-21 | — | — | US | disclosed |
| US-20130123548-A1 | Compounds with a Woody Note | V. MANE FILS (FR) | 2013-05-16 | — | — | US | 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 |
| US-4289659-A | CYCLOHEXANE DERIVATIVES | FIRMENICH SA (CH) | 1981-09-15 | — | — | US | disclosed |
| US-4264467-A | Cyclic C6 compounds and their use in perfumes | FIRMENICH SA (CH) | 1981-04-28 | — | — | US | disclosed |
| US-4147672-A | Cyclic C6 ketones in perfumes | FIRMENICH SA (CH) | 1979-04-03 | — | — | US | disclosed |