⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16288826 | 0.98 | ALDH1A1 (0.37) | — | |
| SCHEMBL16287786 | 0.98 | ALDH1A1 (0.37) | — | |
| SCHEMBL16288758 | 0.98 | ALDH1A1 (0.37) | — | |
| SCHEMBL16288744 | 0.92 | — | — | |
| SCHEMBL966548 | 0.81 | — | — | |
| SCHEMBL16288228 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL16288517 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL16288127 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL1013782 | 0.77 | — | — | |
| SCHEMBL16288239 | 0.76 | ALDH1A1 (0.35) | — |
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-20150045409-A1 | AMIDE COMPOUND AND USE THEREOF FOR PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-02-12 | — | — | US | disclosed |
| EP-2813493-A1 | AMIDE COMPOUND AND USE THEREOF FOR PEST CONTROL | Sumitomo Chemical Company Limited (JP) | 2014-12-17 | — | — | EP | disclosed |