⚠ 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 | |
|---|---|---|---|---|
| Nicosulfuron SCHEMBL7575148 | 0.93 | CDK1 (0.32) | — | |
| Nicosulfuron SCHEMBL7586695 | 0.93 | CDK1 (0.32) | — | |
| Nicosulfuron SCHEMBL7584230 | 0.91 | — | — | |
| Nicosulfuron SCHEMBL7576067 | 0.91 | — | — | |
| Nicosulfuron SCHEMBL7582767 | 0.89 | — | — | |
| Primisulfuron SCHEMBL7579392 | 0.88 | CDK1 (0.30) | — | |
| Rimsulfuron SCHEMBL7583583 | 0.86 | — | — | |
| Nicosulfuron SCHEMBL7588212 | 0.86 | — | — | |
| Nicosulfuron SCHEMBL7582952 | 0.85 | CDK1 (0.37) | — | |
| Atrazine SCHEMBL7586559 | 0.85 | — | — |
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-20020004457-A1 | Herbicidal composition | SYNGENTA PARTICIPATIONS AG (CH) | 2002-01-10 | — | — | US | disclosed |