⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8419883 | 0.69 | — | — | |
| SCHEMBL7636783 | 0.67 | — | — | |
| SCHEMBL7636776 | 0.67 | — | — | |
| SCHEMBL28936026 | 0.67 | — | — | |
| SCHEMBL7763539 | 0.65 | — | — | |
| SCHEMBL3681209 | 0.65 | — | — | |
| SCHEMBL65851 | 0.62 | — | — | |
| SCHEMBL1988100 | 0.62 | — | — | |
| SCHEMBL11857000 | 0.62 | PKM (0.31) | — | |
| SCHEMBL4666919 | 0.62 | — | — |
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-0283261-B2 | Herbicidal substituted cyclic diones | ZENECA LTD (GB) | 1998-09-09 | — | — | EP | disclosed |