⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL330879 | 1.00 | — | — | |
| SCHEMBL8202573 | 0.92 | — | — | |
| SCHEMBL20524241 | 0.82 | ALDH1A1 (0.39) | — | |
| SCHEMBL18967373 | 0.82 | — | — | |
| SCHEMBL24477650 | 0.77 | — | — | |
| SCHEMBL24584579 | 0.77 | — | — | |
| SCHEMBL17192659 | 0.77 | — | — | |
| SCHEMBL24583829 | 0.77 | — | — | |
| SCHEMBL3965932 | 0.77 | — | — | |
| SCHEMBL6852583 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009138657-A1 | NOVEL ALDEHYDES HAVING NORBORNANE STRUCTURE, AND PREPARATION AND USE THEREOF IN PERFUMERY | V. MANE FILS (FR) | 2009-11-19 | — | — | WO | disclosed |
| EP-2112132-A1 | New aldehydes with norbornane structures, their preparation and use in perfume making | V. Mane Fils (FR) | 2009-10-28 | — | — | EP | disclosed |