⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8666073 | 0.74 | — | — | |
| SCHEMBL2702508 | 0.72 | — | — | |
| SCHEMBL105724 | 0.72 | — | — | |
| SCHEMBL7709584 | 0.70 | — | — | |
| SCHEMBL6827582 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL72690 | 0.65 | — | — | |
| SCHEMBL22068853 | 0.65 | — | — | |
| SCHEMBL16905406 | 0.65 | — | — | |
| SCHEMBL1917432 | 0.65 | — | — | |
| SCHEMBL1356839 | 0.65 | — | — |
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-2023081328-A1 | HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF | VALO HEALTH, INC. (US) | 2023-05-11 | — | — | WO | disclosed |