⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13516244 | 0.86 | — | — | |
| SCHEMBL1275128 | 0.83 | GAA (0.30) | — | |
| SCHEMBL13515950 | 0.81 | — | — | |
| SCHEMBL13890497 | 0.81 | GCK (0.32) | — | |
| SCHEMBL3589151 | 0.80 | POLB (0.38) | — | |
| SCHEMBL4602925 | 0.73 | KDM4E (0.33) | — | |
| SCHEMBL13875591 | 0.73 | GAA (0.32) | — | |
| SCHEMBL4194638 | 0.72 | — | — | |
| SCHEMBL13516570 | 0.68 | — | — | |
| SCHEMBL29111963 | 0.67 | GAA (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090099204-A1 | Amide derivative, insecticide containing the same and method for application thereof as insecticide | MITSUI CHEMICALS, INC. (JP) | 2009-04-16 | — | — | US | disclosed |
| EP-1916236-A1 | AMIDE DERIVATIVE, PESTICIDE CONTAINING SUCH COMPOUND AND USE THEREOF | Mitsui Chemicals, Inc. (JP) | 2008-04-30 | — | — | EP | disclosed |