⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1408601 | 1.00 | — | — | |
| SCHEMBL4772315 | 0.94 | — | — | |
| SCHEMBL12386211 | 0.91 | DUT (0.30) | — | |
| SCHEMBL7093044 | 0.91 | DUT (0.30) | — | |
| SCHEMBL7067321 | 0.90 | TK2 (0.34) | — | |
| SCHEMBL5861676 | 0.90 | TK2 (0.34) | — | |
| SCHEMBL5557385 | 0.90 | TK2 (0.34) | — | |
| SCHEMBL2768845 | 0.90 | TK2 (0.34) | — | |
| SCHEMBL1099028 | 0.90 | TK2 (0.34) | — | |
| SCHEMBL5878736 | 0.90 | — | — |
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-7569686-B1 | Compounds and methods for synthesis of bicyclic nucleic acid analogs | ISIS PHARMACEUTICALS, INC. (US) | 2009-08-04 | — | — | US | disclosed |