⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9065603 | 0.60 | — | — | |
| SCHEMBL1753880 | 0.58 | — | — | |
| SCHEMBL4607933 | 0.55 | — | — | |
| SCHEMBL5942499 | 0.55 | — | — | |
| SCHEMBL10976796 | 0.54 | — | — | |
| SCHEMBL5940669 | 0.54 | — | — | |
| SCHEMBL4131164 | 0.48 | — | — | |
| SCHEMBL2811111 | 0.48 | — | — | |
| SCHEMBL7818882 | 0.47 | — | — | |
| SCHEMBL2813150 | 0.46 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7291730-B2 | Pyrimidine compounds and their use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-11-06 | — | — | US | disclosed |
| US-20050107609-A1 | Pyrimidine compounds and their use | SUMITOMO CHEMICAL COMPANY | 2005-05-19 | — | — | US | disclosed |