⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2762868 | 0.79 | PTGDR2 (0.39) | — | |
| SCHEMBL13077939 | 0.67 | PTGDR2 (0.39) | — | |
| SCHEMBL13041557 | 0.66 | PTGDR2 (0.40) | — | |
| SCHEMBL13041570 | 0.66 | PTGDR2 (0.43) | — | |
| SCHEMBL13041578 | 0.66 | PTGDR2 (0.45) | — | |
| SCHEMBL13041564 | 0.64 | L3MBTL1 (0.31) | — | |
| SCHEMBL13041569 | 0.62 | SHMT1 (0.33) | — | |
| SCHEMBL13041580 | 0.62 | PTGDR2 (0.42) | — | |
| SCHEMBL3019695 | 0.62 | ELANE (0.34) | — | |
| SCHEMBL15372511 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009000533-A1 | NOVEL HERBICIDES | SYNGENTA LIMITED (GB) | 2008-12-31 | — | — | WO | disclosed |