⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1149048 | 0.73 | — | — | |
| SCHEMBL11537390 | 0.67 | — | — | |
| SCHEMBL6468139 | 0.67 | — | — | |
| SCHEMBL11090528 | 0.65 | — | — | |
| SCHEMBL20349480 | 0.65 | MEN1 (0.33) | — | |
| SCHEMBL8487629 | 0.62 | — | — | |
| SCHEMBL14785527 | 0.60 | — | — | |
| SCHEMBL2660646 | 0.57 | — | — | |
| SCHEMBL8487630 | 0.57 | — | — | |
| SCHEMBL24496615 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005037797-A1 | SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-04-28 | — | — | WO | disclosed |
| EP-0205024-A2 | 5-Amino-4-heterocyclyl-1-pyridyl-pyrazoles | BAYER AG (DE) | 1986-12-17 | — | — | EP | disclosed |