⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8930505 | 0.77 | — | — | |
| SCHEMBL24407898 | 0.76 | MAPT (0.48) | — | |
| SCHEMBL15131400 | 0.76 | ALDH1A1 (0.45) | — | |
| SCHEMBL10064614 | 0.74 | — | — | |
| SCHEMBL10525776 | 0.74 | — | — | |
| SCHEMBL15964824 | 0.74 | — | — | |
| SCHEMBL10525781 | 0.74 | — | — | |
| SCHEMBL2484336 | 0.70 | — | — | |
| SCHEMBL12501246 | 0.70 | — | — | |
| SCHEMBL3021247 | 0.70 | — | — |
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-2799442-A1 | Modified 2' and 3' -nucleoside prodrugs for treating flaviridae infections | IDENIX Pharmaceuticals, Inc. (US) | 2014-11-05 | — | — | EP | disclosed |