⚠ 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 | |
|---|---|---|---|---|
| Penoxsulam SCHEMBL20723714 | 0.93 | SLC40A1 (0.33) | — | |
| Penoxsulam SCHEMBL20723729 | 0.92 | PTK2 (0.33) | — | |
| Penoxsulam SCHEMBL10325449 | 0.92 | PTK2 (0.33) | — | |
| Penoxsulam SCHEMBL20723813 | 0.91 | SLC40A1 (0.32) | — | |
| Penoxsulam SCHEMBL20723715 | 0.90 | SLC40A1 (0.31) | — | |
| Penoxsulam SCHEMBL20723903 | 0.88 | CCR2 (0.33) | — | |
| Penoxsulam SCHEMBL20723908 | 0.88 | SLC40A1 (0.32) | — | |
| Penoxsulam SCHEMBL20723816 | 0.86 | PTK2 (0.30) | — | |
| Penoxsulam SCHEMBL20723756 | 0.83 | PTK2 (0.33) | — | |
| Penoxsulam SCHEMBL2430920 | 0.80 | PKM (0.37) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3664609-A1 | SYNERGISTIC HERBICIDAL COMBINATIONS | UPL Ltd (IN) | 2020-06-17 | — | — | EP | disclosed |
| WO-2019030614-A1 | SYNERGISTIC HERBICIDAL COMBINATIONS | UPL LTD (IN) | 2019-02-14 | — | — | WO | disclosed |