⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6845304 | 0.88 | KCNH2 (0.46) | — | |
| Bromide SCHEMBL6844788 | 0.85 | KCNH2 (0.44) | — | |
| SCHEMBL6843994 | 0.85 | KCNH2 (0.44) | — | |
| SCHEMBL19723091 | 0.84 | KCNH2 (0.41) | — | |
| SCHEMBL22374375 | 0.80 | KCNH2 (0.39) | — | |
| SCHEMBL5909124 | 0.78 | CHRNB2 (0.30) | — | |
| SCHEMBL26973008 | 0.78 | — | — | |
| SCHEMBL13861306 | 0.78 | — | — | |
| SCHEMBL14371896 | 0.78 | KCNH2 (0.44) | — | |
| SCHEMBL23119845 | 0.78 | KCNH2 (0.44) | — |
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-2023006097-A1 | BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER | 海创药业股份有限公司 | 2023-02-02 | — | — | WO | disclosed |