⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5411408 | 1.00 | — | — | |
| SCHEMBL1251710 | 1.00 | — | — | |
| SCHEMBL9914017 | 0.84 | FUCA1 (0.40) | — | |
| SCHEMBL14025396 | 0.84 | FUCA1 (0.40) | — | |
| SCHEMBL9915194 | 0.84 | FUCA1 (0.40) | — | |
| SCHEMBL9914020 | 0.84 | FUCA1 (0.40) | — | |
| SCHEMBL1252905 | 0.84 | — | — | |
| SCHEMBL20161471 | 0.84 | FUCA1 (0.40) | — | |
| SCHEMBL676905 | 0.79 | SLC6A12 (0.38) | — | |
| SCHEMBL28655709 | 0.79 | SLC6A12 (0.38) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7189688-B2 | Perfuming ingredient with a floral character | FIRMENICH SA (CH) | 2007-03-13 | — | — | US | disclosed |
| EP-1452531-B1 | Perfuming ingredient with a floral character | FIRMENICH & CIE (CH) | 2005-12-28 | — | — | EP | disclosed |
| EP-1452531-A1 | Perfuming ingredient with a floral character | FIRMENICH SA (CH) | 2004-09-01 | — | — | EP | disclosed |
| US-20040167059-A1 | Perfuming ingredient with a floral character | FIRMENICH SA (CH) | 2004-08-26 | — | — | US | disclosed |