⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6369188 | 0.80 | — | — | |
| SCHEMBL3174218 | 0.74 | — | — | |
| SCHEMBL381314 | 0.74 | — | — | |
| SCHEMBL3280370 | 0.74 | ALDH1A1 (0.50) | — | |
| SCHEMBL17445683 | 0.72 | ALDH1A1 (0.47) | — | |
| SCHEMBL19526005 | 0.72 | — | — | |
| Water SCHEMBL7586391 | 0.72 | ALDH1A1 (0.47) | — | |
| SCHEMBL819142 | 0.72 | TET2 (0.50) | — | |
| SCHEMBL8909969 | 0.71 | — | — | |
| SCHEMBL840557 | 0.70 | ALDH1A1 (0.45) | — |
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-1881976-A1 | SUBSTITUTED AMIDE DERIVATIVES AS PROTEIN KINASE INHIBITORS | Amgen Inc., (US) | 2008-01-30 | — | — | EP | claimed |
| WO-2006116713-A1 | SUBSTITUTED AMIDE DERIVATIVES AS PROTEIN KINASE INHIBITORS | AMGEN INC. (US) | 2006-11-02 | — | — | WO | claimed |