⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9493642 | 0.86 | — | — | |
| SCHEMBL8612375 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL16052925 | 0.68 | — | — | |
| SCHEMBL8612259 | 0.67 | RARB (0.32) | — | |
| SCHEMBL4921774 | 0.64 | TRPA1 (0.32) | — | |
| SCHEMBL8609976 | 0.63 | — | — | |
| SCHEMBL11824227 | 0.62 | MEN1 (0.30) | — | |
| SCHEMBL8610756 | 0.61 | ALDH1A1 (0.38) | — | |
| SCHEMBL10362031 | 0.61 | HIF1A (0.30) | — | |
| SCHEMBL3259380 | 0.61 | — | — |
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-0558928-B1 | Furanethers and their use as perfume | FIRMENICH & CIE (CH) | 1998-04-15 | — | — | EP | disclosed |
| EP-0558928-A2 | Furanethers and their use as perfume | FIRMENICH SA (CH) | 1993-09-08 | — | — | EP | disclosed |