⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4681957 | 0.59 | — | — | |
| SCHEMBL9596326 | 0.55 | — | — | |
| SCHEMBL31006109 | 0.49 | CYP19A1 (0.30) | — | |
| SCHEMBL2029 | 0.46 | — | — | |
| SCHEMBL2814 | 0.46 | — | — | |
| SCHEMBL4591460 | 0.46 | — | — | |
| Chlorolithium SCHEMBL28987269 | 0.45 | — | — | |
| SCHEMBL11502069 | 0.43 | CYP2D6 (0.32) | — | |
| SCHEMBL2462233 | 0.42 | — | — | |
| SCHEMBL2462235 | 0.42 | — | — |
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-1919913-A2 | P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME | F.HOFFMANN-LA ROCHE AG (CH) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007023110-A2 | P38 MAP KINASE INHIBITORS AND METHODS FOR USING THE SAME | F. HOFFMANN-LA ROCHE AG (CH) | 2007-03-01 | — | — | WO | disclosed |