⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL601498 | 0.81 | POLB (0.33) | — | |
| SCHEMBL18484 | 0.75 | CA2 (0.38) | — | |
| SCHEMBL2336622 | 0.68 | ALDH1A1 (0.39) | — | |
| SCHEMBL2336317 | 0.65 | NPSR1 (0.37) | — | |
| SCHEMBL604084 | 0.64 | FABP4 (0.33) | — | |
| SCHEMBL2338291 | 0.63 | ALDH1A1 (0.39) | — | |
| SCHEMBL600458 | 0.60 | TLR7 (0.31) | — | |
| SCHEMBL2341529 | 0.60 | ALDH1A1 (0.34) | — | |
| SCHEMBL2338354 | 0.58 | NPSR1 (0.35) | — | |
| SCHEMBL18108 | 0.58 | KMO (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2432780-A1 | PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL | Sumitomo Chemical Company, Limited (JP) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010134478-A1 | PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-11-25 | — | — | WO | disclosed |