⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16752164 | 0.74 | — | — | |
| SCHEMBL3717577 | 0.74 | — | — | |
| SCHEMBL352820 | 0.69 | — | — | |
| SCHEMBL3124813 | 0.67 | MYC (0.40) | — | |
| SCHEMBL337365 | 0.65 | — | — | |
| SCHEMBL379932 | 0.65 | — | — | |
| SCHEMBL600904 | 0.65 | — | — | |
| SCHEMBL4756833 | 0.65 | — | — | |
| SCHEMBL621799 | 0.65 | TSHR (0.38) | — | |
| SCHEMBL15064126 | 0.64 | TSHR (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-2008154905-A2 | MODIFICATIONS OF THE HISTONE DEACETYLASE INHIBITOR SUBEROYLANILIDE HYDROXAMIC ACID | SCHEBO BIOTECH AG (DE) | 2008-12-24 | — | — | WO | disclosed |