⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30184507 | 1.00 | — | — | |
| SCHEMBL25030907 | 0.87 | LMNA (0.35) | — | |
| SCHEMBL30184470 | 0.87 | LMNA (0.35) | — | |
| SCHEMBL30184621 | 0.86 | — | — | |
| SCHEMBL25033173 | 0.86 | — | — | |
| SCHEMBL25033175 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL30184460 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL29212272 | 0.75 | CLCN2 (0.30) | — | |
| SCHEMBL25033174 | 0.74 | ALDH1A1 (0.40) | — | |
| SCHEMBL30184588 | 0.74 | ALDH1A1 (0.40) | — |
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-2023016434-A1 | COMPOUNDS TARGETING MUTANT OF P53 | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2023-02-16 | — | — | WO | disclosed |