⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL100112 | 0.92 | — | — | |
| SCHEMBL135971 | 0.91 | — | — | |
| SCHEMBL135206 | 0.89 | — | — | |
| SCHEMBL99098 | 0.83 | — | — | |
| SCHEMBL100011 | 0.83 | — | — | |
| SCHEMBL99280 | 0.83 | — | — | |
| SCHEMBL99645 | 0.83 | — | — | |
| SCHEMBL133845 | 0.82 | — | — | |
| SCHEMBL3478371 | 0.82 | KMT2A (0.56) | — | |
| SCHEMBL99175 | 0.82 | — | — |
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-20150336965-A1 | NOVEL ANTIVIRAL COMPOUNDS | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2015-11-26 | — | — | US | disclosed |
| US-9132129-B2 | Antiviral compounds | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2015-09-15 | — | — | US | disclosed |