⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6045772 | 0.72 | — | — | |
| SCHEMBL531272 | 0.70 | BTN3A1 (0.31) | — | |
| SCHEMBL28150536 | 0.69 | PYGB (0.30) | — | |
| SCHEMBL4436037 | 0.69 | — | — | |
| SCHEMBL1039509 | 0.67 | BTN3A1 (0.32) | — | |
| SCHEMBL27743482 | 0.67 | — | — | |
| SCHEMBL6045394 | 0.67 | NPSR1 (0.33) | — | |
| SCHEMBL5485606 | 0.67 | — | — | |
| SCHEMBL7796989 | 0.67 | — | — | |
| SCHEMBL28192551 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0646648-A1 | Method for producing polypeptide | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-04-05 | — | — | EP | claimed |