⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11703030 | 0.78 | — | — | |
| SCHEMBL17613394 | 0.75 | — | — | |
| SCHEMBL14355926 | 0.75 | — | — | |
| SCHEMBL173293 | 0.73 | — | — | |
| SCHEMBL27996766 | 0.72 | — | — | |
| SCHEMBL30899744 | 0.72 | — | — | |
| SCHEMBL22916740 | 0.71 | — | — | |
| SCHEMBL4266560 | 0.70 | — | — | |
| SCHEMBL863004 | 0.70 | — | — | |
| SCHEMBL18275146 | 0.67 | LMNA (0.39) | — |
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-2008101186-A1 | INHIBITORS FOR HDAC8 | THE J. DAVID GLADSTONE INSTITUTES (US) | 2008-08-21 | — | — | WO | disclosed |