⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL602765 | 0.90 | LCAT (0.36) | — | |
| SCHEMBL603472 | 0.79 | TRPM8 (0.34) | — | |
| SCHEMBL602808 | 0.75 | — | — | |
| SCHEMBL602893 | 0.74 | CDC7 (0.39) | — | |
| SCHEMBL2334212 | 0.73 | TACR1 (0.34) | — | |
| SCHEMBL600563 | 0.69 | HPGD (0.34) | — | |
| SCHEMBL602766 | 0.68 | LCAT (0.35) | — | |
| SCHEMBL604061 | 0.68 | SDHB (0.33) | — | |
| SCHEMBL601160 | 0.68 | ELANE (0.30) | — | |
| SCHEMBL603721 | 0.68 | KHK (0.32) | — |
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-2432780-A1 | PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL | Sumitomo Chemical Company, Limited (JP) | 2012-03-28 | — | — | EP | disclosed |
| US-20120041009-A1 | PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-02-16 | — | — | US | disclosed |
| WO-2010134478-A1 | PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-11-25 | — | — | WO | disclosed |