⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14767322 | 0.88 | — | — | |
| SCHEMBL25668293 | 0.75 | EGFR (0.30) | — | |
| SCHEMBL13548406 | 0.73 | — | — | |
| SCHEMBL23638849 | 0.64 | PPARG (0.33) | — | |
| SCHEMBL24525250 | 0.62 | — | — | |
| SCHEMBL23351729 | 0.62 | KDM1A (0.48) | — | |
| SCHEMBL20096076 | 0.60 | PKM (0.33) | — | |
| SCHEMBL17083895 | 0.59 | POLB (0.36) | — | |
| SCHEMBL19299765 | 0.58 | — | — | |
| SCHEMBL7940907 | 0.58 | AHR (0.44) | — |
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-2327694-B1 | Substituted 4-amino-picolinic acids and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2013-07-24 | — | — | EP | disclosed |
| EP-2332914-B1 | Substituted 4-amino-picolinic acids and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2013-03-13 | — | — | EP | disclosed |