⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13117364 | 1.00 | — | — | |
| SCHEMBL18699659 | 0.86 | — | — | |
| SCHEMBL640643 | 0.86 | — | — | |
| SCHEMBL16672193 | 0.77 | — | — | |
| SCHEMBL17236505 | 0.75 | — | — | |
| SCHEMBL13679439 | 0.75 | — | — | |
| SCHEMBL710101 | 0.74 | — | — | |
| SCHEMBL1838381 | 0.74 | — | — | |
| SCHEMBL5515701 | 0.74 | — | — | |
| SCHEMBL20068345 | 0.73 | GRIK1 (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-2562162-A1 | 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES | Dow AgroSciences LLC (US) | 2013-02-27 | — | — | EP | disclosed |
| EP-1661567-B1 | Compounds effecting Glucokinase | ASTRAZENECA AB (SE) | 2008-06-11 | — | — | EP | disclosed |
| US-7255935-B2 | Organic electroluminescent element and luminescent apparatus employing the same | SONY CORPORATION (JP) | 2007-08-14 | — | — | US | disclosed |