⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8749367 | 0.87 | SIGMAR1 (0.30) | — | |
| SCHEMBL15369224 | 0.87 | SIGMAR1 (0.30) | — | |
| SCHEMBL21343582 | 0.81 | — | — | |
| SCHEMBL8748467 | 0.75 | — | — | |
| SCHEMBL22364671 | 0.75 | — | — | |
| SCHEMBL10140833 | 0.75 | — | — | |
| SCHEMBL22535001 | 0.70 | — | — | |
| SCHEMBL10147715 | 0.70 | — | — | |
| SCHEMBL19152673 | 0.70 | — | — | |
| SCHEMBL16255621 | 0.69 | TSHR (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3778606-A2 | CONDENSED IMIDAZOLYLIMIDAZOLES AS ANTIVIRAL COMPOUNDS | Gilead Pharmasset LLC (US) | 2021-02-17 | — | — | EP | disclosed |
| EP-2640719-B1 | ANTIVIRAL COMPOUNDS | GILEAD PHARMASSET LLC (US) | 2017-05-10 | — | — | EP | disclosed |