⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31412227 | 0.79 | GAA (0.30) | — | |
| SCHEMBL25205912 | 0.78 | TNKS (0.33) | — | |
| SCHEMBL27137721 | 0.78 | — | — | |
| SCHEMBL38657967 | 0.77 | TNKS (0.35) | — | |
| SCHEMBL30699586 | 0.74 | — | — | |
| SCHEMBL38657977 | 0.71 | KCNH2 (0.42) | — | |
| SCHEMBL25244075 | 0.71 | GAA (0.32) | — | |
| SCHEMBL38659847 | 0.70 | TNF (0.32) | — | |
| SCHEMBL25040414 | 0.70 | GAA (0.33) | — | |
| SCHEMBL30134622 | 0.70 | GAA (0.33) | — |
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-2026098683-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF | 盛睿泽华医药科技（苏州）有限公司 | 2026-05-15 | — | — | WO | disclosed |