⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21095322 | 0.78 | CHRM5 (0.31) | — | |
| SCHEMBL6932362 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL18850030 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL6839591 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL24943522 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL24520605 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL22045699 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL21370154 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL12522349 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL6933813 | 0.73 | TSHR (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 |
|---|---|---|---|---|---|---|---|
| US-20230158155-A1 | Cell Surface Receptor Binding Compounds and Conjugates | LYCIA THERAPEUTICS, INC. | 2023-05-25 | — | — | US | disclosed |