⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22561301 | 0.83 | — | — | |
| SCHEMBL27410348 | 0.79 | CA1 (0.33) | — | |
| SCHEMBL29293332 | 0.74 | — | — | |
| SCHEMBL23193195 | 0.74 | OPRM1 (0.34) | — | |
| SCHEMBL27409838 | 0.73 | FOLH1 (0.31) | — | |
| SCHEMBL27410347 | 0.73 | FOLH1 (0.32) | — | |
| SCHEMBL22561332 | 0.73 | — | — | |
| SCHEMBL22561439 | 0.72 | — | — | |
| SCHEMBL22561326 | 0.72 | — | — | |
| SCHEMBL27189806 | 0.70 | FOLH1 (0.34) | — |
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-2024123914-A1 | PROCESS FOR MAKING ANTIBODY-DRUG CONJUGATES | MERCK SHARP & DOHME LLC (US) | 2024-06-13 | — | — | WO | disclosed |