⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL414441 | 0.73 | — | — | |
| SCHEMBL8519521 | 0.69 | — | — | |
| SCHEMBL6355406 | 0.67 | — | — | |
| SCHEMBL8592365 | 0.67 | TTR (0.32) | — | |
| SCHEMBL9130067 | 0.67 | TTR (0.32) | — | |
| SCHEMBL8111123 | 0.66 | — | — | |
| SCHEMBL8641128 | 0.64 | — | — | |
| SCHEMBL2859619 | 0.64 | — | — | |
| SCHEMBL848613 | 0.63 | — | — | |
| SCHEMBL28796003 | 0.63 | THRB (0.33) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050026998-A1 | Compounds for the controlled release of active aldehydes | FIRMENICH SA (CH) | 2005-02-03 | — | — | US | claimed |
| EP-1487815-A1 | COMPOUNDS FOR THE CONTROLLED RELEASE OF ACTIVE ALDEHYDES | FIRMENICH SA (CH) | 2004-12-22 | — | — | EP | claimed |
| WO-2003082850-A1 | COMPOUNDS FOR THE CONTROLLED RELEASE OF ACTIVE ALDEHYDES | FIRMENICH SA (CH) | 2003-10-09 | — | — | WO | claimed |
| US-20050026998-A1 | Compounds for the controlled release of active aldehydes | FIRMENICH SA (CH) | 2005-02-03 | — | — | US | disclosed |
| EP-1487815-A1 | COMPOUNDS FOR THE CONTROLLED RELEASE OF ACTIVE ALDEHYDES | FIRMENICH SA (CH) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003082850-A1 | COMPOUNDS FOR THE CONTROLLED RELEASE OF ACTIVE ALDEHYDES | FIRMENICH SA (CH) | 2003-10-09 | — | — | WO | disclosed |