⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3714203 | 0.97 | — | — | |
| SCHEMBL4909084 | 0.97 | — | — | |
| SCHEMBL329133 | 0.96 | — | — | |
| SCHEMBL8676190 | 0.93 | — | — | |
| SCHEMBL11766358 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL9805347 | 0.93 | — | — | |
| SCHEMBL9601991 | 0.93 | — | — | |
| SCHEMBL569331 | 0.93 | — | — | |
| Bicarbonate SCHEMBL22439876 | 0.93 | ALDH1A1 (0.60) | — | |
| Hydrochloric Acid SCHEMBL8678062 | 0.93 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2361503-B1 | N-2-(hetero)arylethylcarboxamide derivative, and pest-controlling agent comprising the same | NIHON NOHYAKU CO LTD (JP) | 2015-05-27 | — | — | EP | disclosed |
| CN-1068106-A | The new method synthetic herbicide of monoetherization oxyfluorfen | SHANGHAI AGRICULTURAL CHEMICAL (CN) | 1993-01-20 | — | — | CN | disclosed |