⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34473209 | 1.00 | — | — | |
| SCHEMBL1371466 | 0.86 | — | — | |
| SCHEMBL1621133 | 0.86 | — | — | |
| SCHEMBL172961 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL30578093 | 0.84 | CYP1A2 (0.45) | — | |
| Hydrochloric Acid SCHEMBL34475098 | 0.84 | CYP1A2 (0.45) | — | |
| SCHEMBL481886 | 0.79 | — | — | |
| SCHEMBL6778239 | 0.79 | — | — | |
| SCHEMBL23212276 | 0.77 | — | — | |
| SCHEMBL30929005 | 0.77 | — | — |
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-2026085629-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING THEM AND USES THEREOF | Université de Montréal (CA) | 2026-04-30 | — | — | WO | disclosed |