⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1483337 | 0.90 | — | — | |
| SCHEMBL1483338 | 0.89 | — | — | |
| Bromide SCHEMBL1483232 | 0.88 | — | — | |
| SCHEMBL1483678 | 0.77 | KDM4E (0.38) | — | |
| SCHEMBL1483304 | 0.72 | — | — | |
| SCHEMBL1483313 | 0.71 | ROCK1 (0.36) | — | |
| Hydrochloric Acid SCHEMBL1484299 | 0.70 | ROCK1 (0.35) | — | |
| SCHEMBL1483655 | 0.69 | — | — | |
| SCHEMBL1482815 | 0.69 | ALOX5AP (0.41) | — | |
| SCHEMBL1483251 | 0.69 | ALOX5AP (0.41) | — |
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-1915375-B1 | DERIVATIVES OF 5-PYRIDINYL-1-AZABICYCLO[3.2.1]OCTANE, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS | SANOFI AVENTIS (FR) | 2009-10-07 | — | — | EP | claimed |