⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL254574 | 1.00 | — | — | |
| SCHEMBL20220908 | 0.89 | CYP2C9 (0.33) | — | |
| SCHEMBL19917214 | 0.86 | — | — | |
| SCHEMBL15985688 | 0.82 | CYP2C9 (0.30) | — | |
| SCHEMBL5138190 | 0.81 | — | — | |
| SCHEMBL19730154 | 0.81 | — | — | |
| SCHEMBL21971979 | 0.79 | CYP2C9 (0.32) | — | |
| SCHEMBL3222880 | 0.77 | — | — | |
| SCHEMBL22878856 | 0.77 | — | — | |
| SCHEMBL132918 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116507326-A | Compounds as GLP-1R agonists | 拓臻制药公司 | 2023-07-28 | — | — | CN | disclosed |