⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4063215 | 1.00 | — | — | |
| SCHEMBL5249613 | 0.97 | — | — | |
| SCHEMBL7608823 | 0.91 | — | — | |
| SCHEMBL13057106 | 0.74 | — | — | |
| SCHEMBL9036008 | 0.71 | — | — | |
| SCHEMBL2828422 | 0.71 | — | — | |
| SCHEMBL6057095 | 0.71 | — | — | |
| SCHEMBL5892155 | 0.70 | SLC2A1 (0.32) | — | |
| SCHEMBL6692831 | 0.67 | SLC2A1 (0.31) | — | |
| SCHEMBL21670101 | 0.67 | ADH1C (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 |
|---|---|---|---|---|---|---|---|
| WO-1998007720-A1 | SUBSTITUTED 2-ARYLPYRIDINE AS HERBICIDE | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-26 | — | — | WO | disclosed |