⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10697219 | 0.83 | DHODH (0.31) | — | |
| SCHEMBL7955672 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL10696144 | 0.81 | — | — | |
| SCHEMBL9497504 | 0.80 | — | — | |
| SCHEMBL7832818 | 0.79 | — | — | |
| SCHEMBL10698384 | 0.79 | HPGD (0.32) | — | |
| SCHEMBL2976620 | 0.78 | NOTUM (0.34) | — | |
| SCHEMBL9878117 | 0.78 | HPGD (0.42) | — | |
| SCHEMBL10695876 | 0.77 | BCAT1 (0.34) | — | |
| SCHEMBL10695874 | 0.77 | BCAT1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0255047-A1 | 3-Aryl uraciles and their use as herbicides | CIBA-GEIGY AG (CH) | 1988-02-03 | — | — | EP | disclosed |