⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6815383 | 0.87 | — | — | |
| SCHEMBL6674661 | 0.77 | NPC1 (0.35) | — | |
| SCHEMBL6675186 | 0.77 | MEN1 (0.31) | — | |
| SCHEMBL6819087 | 0.74 | PDE1A (0.39) | — | |
| SCHEMBL6671537 | 0.73 | — | — | |
| SCHEMBL6295365 | 0.72 | HSD11B1 (0.36) | — | |
| SCHEMBL7746904 | 0.72 | SLC34A1 (0.43) | — | |
| SCHEMBL7707584 | 0.72 | KDM4E (0.38) | — | |
| SCHEMBL6675536 | 0.71 | — | — | |
| SCHEMBL6820087 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004035564-A1 | PYRIDINE DERIVATIVES USEFUL AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2004-04-29 | — | — | WO | disclosed |
| WO-2004035563-A1 | 3-HETEROCYCLYLPYRIDINE DERIVATIVES USEFUL AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2004-04-29 | — | — | WO | disclosed |