⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28646512 | 0.84 | MGLL (0.30) | — | |
| SCHEMBL2431617 | 0.83 | MGLL (0.30) | — | |
| SCHEMBL27645580 | 0.83 | GSK3A (0.30) | — | |
| SCHEMBL3847165 | 0.82 | — | — | |
| SCHEMBL26608126 | 0.81 | MGLL (0.31) | — | |
| SCHEMBL1813729 | 0.80 | MGLL (0.32) | — | |
| SCHEMBL45664 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL181744 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL23760484 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL10105716 | 0.75 | ALDH1A1 (0.33) | — |
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-5415995-A | Diagnostic peptides of human papilloma virus | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 1995-05-16 | — | — | US | disclosed |
| EP-0257754-A2 | Synthetic peptides of human Papilloma virus | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 1988-03-02 | — | — | EP | disclosed |