⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9745067 | 0.82 | — | — | |
| SCHEMBL167650 | 0.70 | — | — | |
| SCHEMBL246851 | 0.70 | — | — | |
| SCHEMBL9405666 | 0.67 | — | — | |
| SCHEMBL17838917 | 0.67 | — | — | |
| SCHEMBL17838916 | 0.67 | — | — | |
| SCHEMBL14784756 | 0.67 | — | — | |
| SCHEMBL900190 | 0.64 | — | — | |
| SCHEMBL244436 | 0.64 | — | — | |
| SCHEMBL9117829 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5104440-A | Herbicides | CIBA-GEIGY CORPORATION (US) | 1992-04-14 | — | — | US | disclosed |
| US-5041603-A | Pre-, postemergence herbicides, plant growth regulators, chemical intermediates | CIBA-GEIGY CORPORATION (US) | 1991-08-20 | — | — | US | disclosed |
| US-4780125-A | HERBICIDES | CIBA-GEIGY CORPORATION (US) | 1988-10-25 | — | — | US | disclosed |
| EP-0102925-A2 | N-phenylsulfonyl-N'-pyrimidinyl- and -triazinyl urea | CIBA-GEIGY AG (CH) | 1984-03-14 | — | — | EP | disclosed |