⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8100833 | 0.81 | RAB9A (0.33) | — | |
| SCHEMBL4059934 | 0.80 | CHEK1 (0.35) | — | |
| SCHEMBL8099491 | 0.80 | — | — | |
| Bromide SCHEMBL4063563 | 0.80 | RAB9A (0.32) | — | |
| Bromide SCHEMBL4058827 | 0.79 | CHEK1 (0.34) | — | |
| Bromide SCHEMBL7867093 | 0.79 | — | — | |
| SCHEMBL6626498 | 0.78 | PARP2 (0.39) | — | |
| Bromide SCHEMBL4070073 | 0.76 | PARP2 (0.38) | — | |
| SCHEMBL8098701 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL18232256 | 0.76 | SMN1; SMN2 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6130335-A | N-([1,2,4]triazoloazinyl) benzenesulfonamide and pyridinesulfonamide compounds and their use as herbicides | DOW AGROSCIENCES LLC (US) | 2000-10-10 | — | — | US | disclosed |
| US-6005108-A | POST-EMERGENCE TOTAL VEGETATION CONTROL OR SELECTIVE CONTROL OF WEEDS IN WHEAT, RICE AND OIL-SEED RAPE CROPS | JOHNSON TIMOTHY C (US) | 1999-12-21 | — | — | US | disclosed |
| US-5965490-A | NOVEL COMPOUNDS WITH IMPROVED SELECTIVITY TO VALUABLE CROPS AND IMPROVED TOXICOLOGICAL AND ENVIRONMENTAL ATTRIBUTES; APPLYING TO CONTROL WEEDS BY EITHER PREEMERGENCE OR POSTEMERGENCE APPLICATION | DOW AGROSCIENCES LLC (US) | 1999-10-12 | — | — | US | disclosed |