⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8174592 | 0.77 | HTT (0.46) | — | |
| SCHEMBL775532 | 0.77 | — | — | |
| SCHEMBL24084290 | 0.75 | HTT (0.37) | — | |
| SCHEMBL21092352 | 0.72 | — | — | |
| SCHEMBL333504 | 0.72 | — | — | |
| SCHEMBL680024 | 0.72 | — | — | |
| Phosphonic Acid SCHEMBL8155342 | 0.70 | HTT (0.46) | — | |
| Hydrochloric Acid SCHEMBL31240910 | 0.70 | — | — | |
| SCHEMBL4797496 | 0.69 | HTT (0.50) | — | |
| SCHEMBL4672613 | 0.69 | HTT (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3330259-B1 | 1,3,4-OXADIAZOLE AMIDE DERIVATIVE COMPOUND AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2020-06-10 | — | — | EP | disclosed |