⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL225492 | 1.00 | — | — | |
| SCHEMBL8927859 | 0.72 | — | — | |
| SCHEMBL10655808 | 0.70 | — | — | |
| Chloroacetic Acid SCHEMBL7809354 | 0.67 | — | — | |
| SCHEMBL689061 | 0.67 | — | — | |
| SCHEMBL34263 | 0.67 | — | — | |
| Chloroacetic Acid SCHEMBL1330649 | 0.67 | — | — | |
| SCHEMBL298779 | 0.67 | — | — | |
| SCHEMBL9633661 | 0.67 | — | — | |
| SCHEMBL23160 | 0.67 | — | — |
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-5710100-A | ANTIDOTES WITH HERBICIDES FOR CROPS SUCH AS CORN | MONSANTO COMPANY (US) | 1998-01-20 | — | — | US | claimed |