⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6972248 | 0.79 | — | — | |
| SCHEMBL27595291 | 0.76 | RPS6KA3 (0.38) | — | |
| SCHEMBL3021513 | 0.73 | — | — | |
| SCHEMBL11488096 | 0.73 | — | — | |
| SCHEMBL11488091 | 0.71 | — | — | |
| SCHEMBL6171577 | 0.71 | — | — | |
| SCHEMBL2161855 | 0.71 | — | — | |
| SCHEMBL6968298 | 0.71 | — | — | |
| SCHEMBL27901161 | 0.71 | RPS6KA3 (0.40) | — | |
| SCHEMBL28146907 | 0.70 | GAA (0.50) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |