⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21769856 | 0.87 | L3MBTL1 (0.38) | — | |
| SCHEMBL21769890 | 0.68 | HTT (0.36) | — | |
| SCHEMBL2815306 | 0.68 | HTT (0.39) | — | |
| SCHEMBL28459274 | 0.67 | GAA (0.36) | — | |
| SCHEMBL14000159 | 0.62 | MAPT (0.37) | — | |
| SCHEMBL14000191 | 0.61 | SLC6A9 (0.43) | — | |
| SCHEMBL2815309 | 0.60 | HTT (0.39) | — | |
| SCHEMBL29031636 | 0.57 | CNR2 (0.49) | — | |
| SCHEMBL21769889 | 0.56 | HTT (0.39) | — | |
| SCHEMBL28453946 | 0.55 | KDM4E (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-2020038812-A1 | NEW PROCESS FOR THE PREPARATION OF AMENAMEVIR | RIJKSUNIVERSITEIT GRONINGEN (NL) | 2020-02-27 | — | — | WO | disclosed |