⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9229762 | 0.85 | ACLY (0.33) | — | |
| SCHEMBL27360980 | 0.83 | ACLY (0.36) | — | |
| SCHEMBL27360965 | 0.81 | ACLY (0.39) | — | |
| SCHEMBL14139891 | 0.81 | — | — | |
| SCHEMBL3714708 | 0.78 | — | — | |
| SCHEMBL6180108 | 0.78 | TRPA1 (0.33) | — | |
| SCHEMBL1114607 | 0.78 | ACLY (0.38) | — | |
| SCHEMBL3950975 | 0.76 | — | — | |
| SCHEMBL1854344 | 0.76 | — | — | |
| SCHEMBL10518207 | 0.76 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641337-A1 | CYCLIC ALKYLIDENE SUBSTITUTED PYRIDINE HERBICIDES | ROHM AND HAAS COMPANY (US) | 1995-03-08 | — | — | EP | disclosed |
| EP-0435843-B1 | Substituted pyridine compounds | MONSANTO CO (US) | 1994-06-15 | — | — | EP | disclosed |
| WO-1992021674-A1 | CYCLIC ALKYLIDENE SUBSTITUTED PYRIDINE HERBICIDES | MONSANTO COMPANY (US) | 1992-12-10 | — | — | WO | disclosed |
| US-5156670-A | Low soil mobility | MONSANTO COMPANY (US) | 1992-10-20 | — | — | US | disclosed |
| US-5129943-A | Herbicides | MONSANTO COMPANY (US) | 1992-07-14 | — | — | US | disclosed |
| US-5114465-A | Substituted pyridine compounds and herbicidal compositions and methods | MONSANTO COMPANY (US) | 1992-05-19 | — | — | US | disclosed |
| US-5112980-A | Intermediates for herbicides | MONSANTO COMPANY (US) | 1992-05-12 | — | — | US | disclosed |
| EP-0435844-A1 | Substituted pyridine compounds | MONSANTO COMPANY (US) | 1991-07-03 | — | — | EP | disclosed |
| EP-0435843-A1 | Substituted pyridine compounds | MONSANTO COMPANY (US) | 1991-07-03 | — | — | EP | disclosed |