⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31570653 | 0.83 | — | — | |
| SCHEMBL31570579 | 0.69 | — | — | |
| SCHEMBL31570473 | 0.69 | BACE1 (0.33) | — | |
| SCHEMBL31570626 | 0.68 | — | — | |
| SCHEMBL31570413 | 0.66 | ALOX5AP (0.30) | — | |
| SCHEMBL31570581 | 0.63 | FEN1 (0.38) | — | |
| SCHEMBL29112122 | 0.62 | MTOR (0.38) | — | |
| SCHEMBL25190870 | 0.62 | — | — | |
| SCHEMBL31438500 | 0.62 | — | — | |
| SCHEMBL23580186 | 0.62 | OPRL1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025099451-A1 | NEW COMPOUNDS AND METHODS | Transition Bio Limited (GB) | 2025-05-15 | — | — | WO | disclosed |