⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31369016 | 1.00 | — | — | |
| SCHEMBL16551693 | 0.82 | — | — | |
| SCHEMBL7674315 | 0.74 | GAA (0.41) | — | |
| SCHEMBL837169 | 0.73 | — | — | |
| SCHEMBL80716 | 0.72 | — | — | |
| SCHEMBL13397713 | 0.71 | ALDH1A1 (0.38) | — | |
| SCHEMBL252442 | 0.71 | — | — | |
| SCHEMBL11138801 | 0.71 | TSHR (0.47) | — | |
| SCHEMBL1276314 | 0.69 | — | — | |
| SCHEMBL17361362 | 0.69 | ALDH1A1 (0.43) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025031576-A1 | NEW PERFUMES AND USES THEREOF | SYMRISE AG (DE) | 2025-02-13 | — | — | WO | disclosed |