⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1841547 | 0.84 | — | — | |
| SCHEMBL1842080 | 0.81 | — | — | |
| SCHEMBL4171790 | 0.74 | EPAS1 (0.32) | — | |
| SCHEMBL1846413 | 0.69 | — | — | |
| SCHEMBL1360719 | 0.69 | — | — | |
| SCHEMBL697266 | 0.64 | ALDH1A1 (0.42) | — | |
| SCHEMBL699051 | 0.63 | CA1 (0.34) | — | |
| SCHEMBL19210157 | 0.63 | — | — | |
| SCHEMBL17159495 | 0.62 | — | — | |
| SCHEMBL697575 | 0.62 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| EP-2325165-A1 | AMIDE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE AMIDE DERIVATIVE AND PEST CONTROLLING METHOD | Mitsui Chemicals Agro, Inc. (JP) | 2011-05-25 | — | — | EP | disclosed |