⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24912872 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL24098460 | 0.66 | — | — | |
| Ammonia Solution, Strong SCHEMBL1665006 | 0.65 | — | — | |
| SCHEMBL21583882 | 0.62 | MAOB (0.36) | — | |
| SCHEMBL24912890 | 0.62 | — | — | |
| SCHEMBL21583880 | 0.57 | — | — | |
| SCHEMBL24952439 | 0.55 | FDPS (0.32) | — | |
| SCHEMBL24391578 | 0.54 | — | — | |
| SCHEMBL10615832 | 0.54 | — | — | |
| SCHEMBL10615824 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20240208932-A1 | ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF | XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) | 2024-06-27 | — | — | US | disclosed |