⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18717711 | 0.86 | — | — | |
| SCHEMBL23542017 | 0.80 | TLR8 (0.32) | — | |
| SCHEMBL18717714 | 0.73 | — | — | |
| SCHEMBL16161007 | 0.71 | CA1 (0.40) | — | |
| SCHEMBL9900218 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL13559669 | 0.68 | — | — | |
| SCHEMBL12265152 | 0.68 | POLB (0.34) | — | |
| SCHEMBL13508818 | 0.67 | — | — | |
| SCHEMBL11741265 | 0.67 | ACHE (0.30) | — | |
| SCHEMBL776394 | 0.67 | ACHE (0.30) | — |
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-9101628-B2 | Methods and composition of treating a flaviviridae family viral infection | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2015-08-11 | — | — | US | disclosed |
| US-20100028299-A1 | Methods and compositions of treating a flaviviridae family viral infection | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY | 2010-02-04 | — | — | US | disclosed |