⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13865292 | 0.77 | — | — | |
| SCHEMBL10880469 | 0.72 | — | — | |
| SCHEMBL25714594 | 0.70 | — | — | |
| SCHEMBL23716614 | 0.70 | HTT (0.33) | — | |
| SCHEMBL24759193 | 0.70 | HTT (0.33) | — | |
| SCHEMBL9895236 | 0.70 | MAPT (0.31) | — | |
| SCHEMBL24233828 | 0.67 | — | — | |
| SCHEMBL10416262 | 0.67 | — | — | |
| SCHEMBL26251119 | 0.67 | — | — | |
| SCHEMBL19850985 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090131444-A1 | Aminopiperidine Quinolines and Their Azaisosteric Analogues with Antibacterial Activity | ASTRAZENECA AB (SE) | 2009-05-21 | — | — | US | disclosed |