⚠ 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 | |
|---|---|---|---|---|
| Phosphonic Acid SCHEMBL8386186 | 0.72 | — | — | |
| SCHEMBL5517591 | 0.70 | — | — | |
| SCHEMBL9356466 | 0.68 | — | — | |
| SCHEMBL96 | 0.66 | — | — | |
| SCHEMBL8387751 | 0.66 | — | — | |
| SCHEMBL8390948 | 0.65 | — | — | |
| SCHEMBL28903624 | 0.64 | — | — | |
| SCHEMBL28903620 | 0.64 | — | — | |
| SCHEMBL20535561 | 0.64 | — | — | |
| Phosphonic Acid SCHEMBL8387753 | 0.64 | AR (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5922644-A | POSTEMERGENCE HERBICIDES EFFECTIVE AGAINST A BROAD RANGE OF WEED SPECIES; MAY BE USED AS SELECTIVE HERBICIDES IN SOYA, SUGAR BEET, AND OIL-SEED RAPE CROPS | ZENECA LIMITED (GB) | 1999-07-13 | — | — | US | disclosed |
| EP-0625873-B1 | PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES | ZENECA LTD (GB) | 1997-11-05 | — | — | EP | disclosed |
| US-5393732-A | Triazole phosphoric acid derivatives and their use as herbicides | ZENECA LIMITED (GB) | 1995-02-28 | — | — | US | disclosed |
| EP-0625873-A1 | PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES | ZENECA LIMITED (GB) | 1994-11-30 | — | — | EP | disclosed |
| WO-1993015610-A1 | PHOSPHONIC ACID DERIVATIVES CONTAINING A TRIAZOLE RING AS HERBICIDES | ZENECA LIMITED (GB) | 1993-08-19 | — | — | WO | disclosed |