⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3861378 | 0.85 | MGLL (0.32) | — | |
| SCHEMBL18329387 | 0.84 | — | — | |
| SCHEMBL13433487 | 0.83 | — | — | |
| SCHEMBL22096168 | 0.80 | PRKCA (0.36) | — | |
| SCHEMBL16883986 | 0.80 | ADORA3 (0.32) | — | |
| SCHEMBL14108538 | 0.79 | PRKCA (0.38) | — | |
| SCHEMBL15180432 | 0.78 | — | — | |
| SCHEMBL20999957 | 0.77 | — | — | |
| SCHEMBL21651682 | 0.77 | — | — | |
| SCHEMBL12532356 | 0.77 | PSMB8 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140323392-A1 | METHODS AND COMPOSITIONS RELATED TO INHIBITION OF VIRAL ENTRY | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 2014-10-30 | — | — | US | disclosed |
| US-20140323392-A1 | METHODS AND COMPOSITIONS RELATED TO INHIBITION OF VIRAL ENTRY | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 2014-10-30 | — | — | US | disclosed |