⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2199 | 0.70 | — | — | |
| SCHEMBL6169009 | 0.67 | — | — | |
| SCHEMBL1109969 | 0.64 | — | — | |
| SCHEMBL379983 | 0.64 | — | — | |
| SCHEMBL2910395 | 0.64 | — | — | |
| SCHEMBL128802 | 0.64 | — | — | |
| SCHEMBL18533140 | 0.64 | — | — | |
| SCHEMBL967131 | 0.64 | — | — | |
| SCHEMBL780332 | 0.64 | — | — | |
| SCHEMBL6989006 | 0.64 | — | — |
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-4312662-A | N-Substituted carboxy-N-phosphonomethylglycines and the salts thereof as herbicides | MONSANTO COMPANY (US) | 1982-01-26 | — | — | US | disclosed |