⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2893036 | 0.55 | — | — | |
| SCHEMBL1614214 | 0.50 | — | — | |
| SCHEMBL3507843 | 0.50 | — | — | |
| Hno SCHEMBL7785053 | 0.47 | — | — | |
| SCHEMBL4612555 | 0.47 | — | — | |
| Hno SCHEMBL14889227 | 0.47 | — | — | |
| Hno SCHEMBL2771 | 0.47 | — | — | |
| SCHEMBL288603 | 0.47 | — | — | |
| Hno SCHEMBL9340257 | 0.41 | — | — | |
| SCHEMBL11524190 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6939831-B1 | Pestcide and/or plant growth regulating compositions | AVENTIS CROPSCIENCE S.A. (FR) | 2005-09-06 | — | — | US | disclosed |