⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2476295 | 0.70 | — | — | |
| Dimethyl Sulfoxide SCHEMBL7862291 | 0.60 | — | — | |
| Dimethyl Sulfoxide SCHEMBL7867399 | 0.60 | — | — | |
| SCHEMBL385016 | 0.59 | — | — | |
| SCHEMBL9637004 | 0.56 | — | — | |
| Water SCHEMBL8463487 | 0.56 | — | — | |
| Bromide SCHEMBL11071949 | 0.56 | — | — | |
| SCHEMBL10403962 | 0.56 | — | — | |
| Iodide SCHEMBL6829296 | 0.56 | — | — | |
| SCHEMBL2904 | 0.54 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2084153-A1 | THIONUCLEOSIDES AND PHARMACEUTICAL APPLICATIONS | UNIVERSITE JOSEPH FOURIER (GRENOBLE 1) (FR) | 2009-08-05 | — | — | EP | disclosed |
| WO-2008059130-A1 | THIONUCLEOSIDES AND PHARMACEUTICAL APPLICATIONS | UNIVERSITE JOSEPH FOURIER (GRENOBLE 1) (FR) | 2008-05-22 | — | — | WO | disclosed |