⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2530575 | 0.71 | — | — | |
| SCHEMBL20806089 | 0.67 | MAPT (0.36) | — | |
| SCHEMBL5610399 | 0.64 | — | — | |
| SCHEMBL642226 | 0.64 | — | — | |
| SCHEMBL25472658 | 0.57 | KDM4E (0.39) | — | |
| SCHEMBL3169511 | 0.56 | MGLL (1.00) | — | |
| SCHEMBL28219 | 0.55 | — | — | |
| SCHEMBL29350069 | 0.55 | — | — | |
| SCHEMBL15071251 | 0.55 | KDM4E (0.52) | — | |
| SCHEMBL10753913 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1754710-A2 | 2'-Fluoroncucleosides | Emory University (US) | 2007-02-21 | — | — | EP | disclosed |