⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6168840 | 0.76 | — | — | |
| SCHEMBL9108167 | 0.76 | — | — | |
| SCHEMBL6638139 | 0.76 | — | — | |
| Acetone SCHEMBL28266445 | 0.75 | ALDH1A1 (0.43) | — | |
| SCHEMBL7648067 | 0.74 | — | — | |
| SCHEMBL10879759 | 0.74 | ALDH1A1 (0.37) | — | |
| SCHEMBL2870019 | 0.73 | — | — | |
| SCHEMBL8085073 | 0.73 | THRB (0.36) | — | |
| SCHEMBL260629 | 0.73 | — | — | |
| SCHEMBL6053661 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1122244-B1 | Uracil compounds and their use | SUMITOMO CHEMICAL CO (JP) | 2004-09-29 | — | — | EP | disclosed |
| US-6537948-B1 | Have a wide range of herbicidal spectrum, and causes no phytotoxicity on crops | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-03-25 | — | — | US | disclosed |
| EP-1122244-A1 | Uracil compounds and their use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-08-08 | — | — | EP | disclosed |