⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2278609 | 0.82 | — | — | |
| SCHEMBL25600814 | 0.82 | — | — | |
| SCHEMBL14175035 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL19086630 | 0.76 | PRMT3 (0.31) | — | |
| SCHEMBL27261740 | 0.76 | — | — | |
| SCHEMBL17662675 | 0.76 | EPHX1 (0.33) | — | |
| SCHEMBL17378005 | 0.74 | EPHX1 (0.37) | — | |
| SCHEMBL22641048 | 0.74 | SLC6A4 (0.38) | — | |
| SCHEMBL16408062 | 0.74 | PRMT1 (0.32) | — | |
| SCHEMBL25819859 | 0.74 | SLC6A4 (0.36) | — |
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 |