⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18822 | 0.69 | — | — | |
| SCHEMBL21787 | 0.69 | — | — | |
| SCHEMBL332995 | 0.65 | — | — | |
| SCHEMBL20528031 | 0.64 | — | — | |
| SCHEMBL16666599 | 0.63 | — | — | |
| Alcohol SCHEMBL958089 | 0.63 | ALDH1A1 (0.32) | — | |
| SCHEMBL6033935 | 0.63 | — | — | |
| SCHEMBL7060937 | 0.63 | — | — | |
| SCHEMBL22103917 | 0.63 | — | — | |
| SCHEMBL2608633 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104395289-B | Amide compound and Pesticidal purposes thereof | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2016-05-11 | — | — | CN | disclosed |