⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2946130 | 0.68 | ADRA1A (0.41) | — | |
| SCHEMBL3309997 | 0.68 | ADRA1A (0.41) | — | |
| SCHEMBL4076784 | 0.68 | ADRA1A (0.41) | — | |
| SCHEMBL550173 | 0.67 | ADRA1A (0.40) | — | |
| SCHEMBL1917618 | 0.67 | ADRA1A (0.40) | — | |
| SCHEMBL399938 | 0.65 | — | — | |
| SCHEMBL21831955 | 0.64 | ADRA1A (0.38) | — | |
| Hydrochloric Acid SCHEMBL1994830 | 0.64 | ADRA1A (0.38) | — | |
| SCHEMBL19661014 | 0.63 | ADRA1A (0.47) | — | |
| Hydrochloric Acid SCHEMBL6421110 | 0.63 | ADRA1A (0.37) | — |
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-2001007409-A1 | CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS | ASTRAZENECA UK LIMITED (GB) | 2001-02-01 | — | — | WO | disclosed |