⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12114737 | 0.87 | SLC28A1 (0.33) | — | |
| SCHEMBL1318144 | 0.87 | SLC28A1 (0.33) | — | |
| SCHEMBL10275988 | 0.84 | ROCK2 (0.33) | — | |
| SCHEMBL16229080 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL14418608 | 0.82 | LMNA (0.34) | — | |
| SCHEMBL10276358 | 0.80 | CTSK (0.33) | — | |
| SCHEMBL16243285 | 0.79 | LMNA (0.35) | — | |
| SCHEMBL16243281 | 0.78 | LMNA (0.34) | — | |
| SCHEMBL17426454 | 0.77 | LMNA (0.36) | — | |
| SCHEMBL17417844 | 0.77 | LMNA (0.36) | — |
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-20070218490-A1 | NUCLEIC ACID MONOMERS WITH 2'-CHEMICAL MOIETIES | INTEGRATED DNA TECHNOLOGIES, INC. (US) | 2007-09-20 | — | — | US | disclosed |