⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29690175 | 0.83 | — | — | |
| SCHEMBL29690243 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL29690358 | 0.80 | MAPK1 (0.36) | — | |
| SCHEMBL29690407 | 0.80 | ALDH1A1 (0.34) | — | |
| SCHEMBL29690231 | 0.78 | MAPK1 (0.30) | — | |
| SCHEMBL23075111 | 0.77 | — | — | |
| SCHEMBL679721 | 0.77 | EGFR (0.33) | — | |
| SCHEMBL29690131 | 0.75 | — | — | |
| SCHEMBL29690226 | 0.75 | — | — | |
| SCHEMBL3278006 | 0.75 | EGFR (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4277591-A1 | ETHER COMPOUNDS AS VOLATILES FOR THE TREATMENT OF AMINO ACID BASED SUBSTRATES, SUCH AS SKIN AND HAIR | Momentive Performance Materials GmbH (DE) | 2023-11-22 | — | — | EP | claimed |
| WO-2022152742-A1 | ETHER COMPOUNDS AS VOLATILES FOR THE TREATMENT OF AMINO ACID BASED SUBSTRATES, SUCH AS SKIN AND HAIR | MOMENTIVE PERFORMANCE MATERIALS GMBH (DE) | 2022-07-21 | — | — | WO | claimed |