⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7869357 | 0.79 | — | — | |
| SCHEMBL7872873 | 0.76 | — | — | |
| SCHEMBL101539 | 0.72 | — | — | |
| SCHEMBL6113141 | 0.71 | — | — | |
| SCHEMBL19373406 | 0.71 | — | — | |
| SCHEMBL22027595 | 0.69 | TSHR (0.44) | — | |
| SCHEMBL598768 | 0.69 | TSHR (0.44) | — | |
| SCHEMBL21022142 | 0.69 | METAP1 (0.36) | — | |
| SCHEMBL7875942 | 0.69 | — | — | |
| SCHEMBL14624665 | 0.67 | — | — |
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-1483249-A1 | PYRIMIDINE COMPOUNDS AND THEIR USE AS PESTICIDES | Sumitomo Chemical Company, Limited (JP) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076415-A1 | PYRIMIDINE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2003-09-18 | — | — | WO | disclosed |