⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8467448 | 0.71 | MGLL (1.00) | — | |
| SCHEMBL5659264 | 0.69 | — | — | |
| SCHEMBL27605000 | 0.69 | — | — | |
| Iodide SCHEMBL1545170 | 0.68 | FAAH (0.34) | — | |
| SCHEMBL9871978 | 0.67 | PHGDH (0.68) | — | |
| Cystogon SCHEMBL220119 | 0.66 | — | — | |
| SCHEMBL5506106 | 0.65 | — | — | |
| SCHEMBL4268624 | 0.63 | FAAH (0.31) | — | |
| SCHEMBL4274516 | 0.62 | FAAH (0.38) | — | |
| SCHEMBL4274519 | 0.62 | FAAH (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6262275-B1 | AS HERBICIDES | NIHON BAYER AGROCHEM K.K. (JP) | 2001-07-17 | — | — | US | disclosed |
| US-6017853-A | HERBICIDES; CHEMICAL INTERMEDIATES | NIHON BAYER AGROCHEM K.K. (JP) | 2000-01-25 | — | — | US | disclosed |