⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5909441 | 0.85 | SNCA (0.30) | — | |
| SCHEMBL5173458 | 0.82 | POLB (0.38) | — | |
| SCHEMBL5171573 | 0.82 | KMT2A (0.35) | — | |
| SCHEMBL5909459 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL5174472 | 0.82 | NAMPT (0.33) | — | |
| SCHEMBL5909450 | 0.80 | KDM4E (0.31) | — | |
| SCHEMBL1131639 | 0.78 | L3MBTL1 (0.31) | — | |
| SCHEMBL5173833 | 0.77 | MAPT (0.44) | — | |
| SCHEMBL5175826 | 0.76 | HDAC1 (0.39) | — | |
| SCHEMBL15875166 | 0.75 | NFKB1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20060194801-A1 | Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same | EVOTEC AG (DE) | 2006-08-31 | — | — | US | claimed |