⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL797019 | 0.72 | — | — | |
| SCHEMBL3183074 | 0.54 | — | — | |
| SCHEMBL800202 | 0.53 | — | — | |
| SCHEMBL800245 | 0.50 | — | — | |
| SCHEMBL16253917 | 0.50 | — | — | |
| SCHEMBL12038913 | 0.50 | — | — | |
| SCHEMBL7777525 | 0.43 | — | — | |
| SCHEMBL11505961 | 0.43 | — | — | |
| SCHEMBL12799360 | 0.43 | — | — | |
| SCHEMBL13944882 | 0.43 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180020663-A1 | CONJUGATED POLYELECTROLYTES AND METHODS OF USING THE SAME | THE REGENTS OF THE UNIVERSITY OF NEW MEXICO | 2018-01-25 | — | — | US | disclosed |