⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24302593 | 0.77 | — | — | |
| SCHEMBL27355456 | 0.77 | — | — | |
| SCHEMBL10083387 | 0.77 | — | — | |
| SCHEMBL24302591 | 0.77 | — | — | |
| SCHEMBL26544762 | 0.77 | — | — | |
| SCHEMBL21118042 | 0.75 | — | — | |
| SCHEMBL19265033 | 0.75 | — | — | |
| SCHEMBL24355850 | 0.74 | — | — | |
| SCHEMBL13810506 | 0.73 | — | — | |
| SCHEMBL22780616 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3524324-A1 | HISTONE DEACETYLASE INHIBITORS | BioMarin Pharmaceutical Inc. (US) | 2019-08-14 | — | — | EP | disclosed |
| EP-1768940-B1 | AN ENCAPSULATED PARTICLE | BASF CORP (US) | 2018-05-02 | — | — | EP | disclosed |