⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11590989 | 0.97 | MEN1 (0.64) | — | |
| SCHEMBL4583144 | 0.88 | — | — | |
| SCHEMBL8694189 | 0.77 | SMN1; SMN2 (0.47) | — | |
| SCHEMBL6505664 | 0.77 | USP2 (0.67) | — | |
| SCHEMBL4209395 | 0.77 | — | — | |
| SCHEMBL10895166 | 0.77 | MEN1 (0.94) | — | |
| SCHEMBL2272092 | 0.77 | — | — | |
| SCHEMBL27238080 | 0.75 | KMT2A (0.50) | — | |
| SCHEMBL19904647 | 0.75 | MEN1 (0.50) | — | |
| SCHEMBL27238078 | 0.75 | KMT2A (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2323978-A1 | AMIDE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010018874-A1 | AMIDE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-02-18 | — | — | WO | disclosed |
| US-20100041891-A1 | AMIDE COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-02-18 | — | — | US | disclosed |