⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18591774 | 0.71 | PRCP (0.42) | — | |
| SCHEMBL18591772 | 0.66 | SLC6A2 (0.40) | — | |
| SCHEMBL18591791 | 0.64 | GBA2 (0.34) | — | |
| SCHEMBL21965867 | 0.64 | DRD2 (0.46) | — | |
| SCHEMBL22564905 | 0.63 | HRH3 (0.37) | — | |
| SCHEMBL16939205 | 0.63 | KDM4E (0.40) | — | |
| SCHEMBL26972342 | 0.62 | GBA2 (0.36) | — | |
| SCHEMBL20234551 | 0.62 | MAOB (0.38) | — | |
| SCHEMBL23664608 | 0.60 | HRH3 (0.41) | — | |
| SCHEMBL10223194 | 0.60 | KDM4E (0.43) | — |
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 |