⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30946342 | 0.84 | CNR2 (0.33) | — | |
| SCHEMBL30817672 | 0.81 | — | — | |
| SCHEMBL30799489 | 0.79 | CTSC (0.35) | — | |
| SCHEMBL29545820 | 0.79 | CTSC (0.33) | — | |
| SCHEMBL30987834 | 0.78 | — | — | |
| SCHEMBL13958826 | 0.77 | CTSC (0.34) | — | |
| SCHEMBL22369842 | 0.77 | CTSC (0.34) | — | |
| SCHEMBL16362464 | 0.77 | CTSC (0.32) | — | |
| SCHEMBL5554652 | 0.76 | — | — | |
| SCHEMBL31388739 | 0.72 | GRB2 (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 |
|---|---|---|---|---|---|---|---|
| CN-117586375-B | Method for preparing semaglutin | 苏州金顶生物有限公司 | 2024-07-30 | — | — | CN | disclosed |