⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4084061 | 0.92 | — | — | |
| SCHEMBL13722154 | 0.89 | DUT (0.31) | — | |
| SCHEMBL4079323 | 0.84 | TDP1 (0.33) | — | |
| SCHEMBL13721971 | 0.81 | DUT (0.30) | — | |
| SCHEMBL13722081 | 0.81 | P2RY6 (0.34) | — | |
| SCHEMBL4078241 | 0.81 | — | — | |
| SCHEMBL13722465 | 0.81 | TDP1 (0.32) | — | |
| SCHEMBL4082343 | 0.81 | TDP1 (0.36) | — | |
| SCHEMBL4082341 | 0.81 | TDP1 (0.36) | — | |
| SCHEMBL13722483 | 0.80 | VDR (0.31) | — |
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 |