⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6135009 | 0.83 | — | — | |
| SCHEMBL6135004 | 0.83 | — | — | |
| SCHEMBL9034009 | 0.65 | — | — | |
| SCHEMBL3078327 | 0.65 | — | — | |
| SCHEMBL27278003 | 0.63 | — | — | |
| SCHEMBL2851397 | 0.61 | POLB (0.33) | — | |
| Hydrochloric Acid SCHEMBL23250525 | 0.61 | — | — | |
| SCHEMBL16216201 | 0.61 | — | — | |
| SCHEMBL8251589 | 0.59 | — | — | |
| SCHEMBL1491235 | 0.59 | — | — |
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-1066315-B1 | USE OF INHIBITORS OF MAMMALIAN ASPARAGINYL ENDOPEPTIDASE FOR MODULATING THE IMMUNE SYSTEM | UNIV DUNDEE (GB) | 2008-05-28 | — | — | EP | disclosed |