⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10079780 | 0.86 | — | — | |
| SCHEMBL10079519 | 0.80 | — | — | |
| SCHEMBL13263626 | 0.79 | — | — | |
| SCHEMBL10084719 | 0.75 | — | — | |
| SCHEMBL10079698 | 0.72 | EHMT2 (0.31) | — | |
| SCHEMBL13263832 | 0.70 | EHMT2 (0.33) | — | |
| SCHEMBL10079730 | 0.69 | EHMT2 (0.30) | — | |
| SCHEMBL10079706 | 0.69 | EHMT2 (0.30) | — | |
| SCHEMBL10079708 | 0.68 | NPSR1 (0.32) | — | |
| SCHEMBL10085583 | 0.68 | — | — |
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-20120046464-A1 | Cyclic Diones and Their Use as Insecticides, Acaricides and/or Fungicides | BAYER CROPSCIENCE AG (DE) | 2012-02-23 | — | — | US | disclosed |