⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11052009 | 0.79 | — | — | |
| SCHEMBL16722800 | 0.77 | — | — | |
| SCHEMBL10403168 | 0.74 | — | — | |
| SCHEMBL3865966 | 0.74 | — | — | |
| SCHEMBL10403166 | 0.74 | — | — | |
| SCHEMBL673236 | 0.72 | — | — | |
| SCHEMBL8467419 | 0.72 | — | — | |
| SCHEMBL18827449 | 0.72 | — | — | |
| SCHEMBL3864690 | 0.70 | TDP1 (0.50) | — | |
| SCHEMBL3072338 | 0.70 | TDP1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4456465-A | HERBICIDES | ZOECON CORPORATION (US) | 1984-06-26 | — | — | US | disclosed |