⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8355299 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL9577971 | 0.74 | — | — | |
| SCHEMBL24003245 | 0.71 | — | — | |
| Bromide SCHEMBL15671513 | 0.68 | — | — | |
| SCHEMBL18924917 | 0.68 | — | — | |
| SCHEMBL5305883 | 0.68 | — | — | |
| SCHEMBL24850640 | 0.65 | — | — | |
| Bromide SCHEMBL3390866 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL3385400 | 0.65 | — | — | |
| Iodide SCHEMBL28409384 | 0.65 | — | — |
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-9938236-B2 | Antiviral agents against HBV infection | DREXEL UNIVERSITY (US) | 2018-04-10 | — | — | US | disclosed |