⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14030365 | 0.89 | POLB (0.33) | — | |
| SCHEMBL14030383 | 0.84 | GRM5 (0.33) | — | |
| SCHEMBL14030258 | 0.71 | POLB (0.47) | — | |
| SCHEMBL13093269 | 0.70 | GRM5 (0.34) | — | |
| SCHEMBL14030286 | 0.69 | POLB (0.55) | — | |
| SCHEMBL14030375 | 0.68 | POLB (0.58) | — | |
| SCHEMBL14030416 | 0.68 | GRM5 (0.33) | — | |
| SCHEMBL14030382 | 0.67 | — | — | |
| SCHEMBL14030349 | 0.66 | GRM5 (0.31) | — | |
| SCHEMBL12510366 | 0.62 | POLB (0.55) | — |
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-20080261970-A1 | Sufonamides and Uses Thereof | ELIXIR PHARMACEUTICALS, INC. (US) | 2008-10-23 | — | — | US | disclosed |