⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1583735 | 0.71 | POLB (0.32) | — | |
| SCHEMBL27407554 | 0.71 | — | — | |
| SCHEMBL12598830 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL5539110 | 0.69 | SLC6A2 (0.32) | — | |
| SCHEMBL20936293 | 0.68 | — | — | |
| SCHEMBL19902315 | 0.67 | — | — | |
| Bromide SCHEMBL27475686 | 0.64 | CA12 (0.31) | — | |
| SCHEMBL22268222 | 0.64 | — | — | |
| SCHEMBL27537600 | 0.62 | LMNA (0.35) | — | |
| SCHEMBL19449177 | 0.61 | SIGMAR1 (0.32) | — |
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-10723733-B2 | Hepatitis B antiviral agents | ENANTA PHARMACEUTICALS, INC. (US) | 2020-07-28 | — | — | US | disclosed |