⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22718764 | 0.87 | — | — | |
| SCHEMBL22718580 | 0.80 | NR1H2 (0.37) | — | |
| SCHEMBL26645617 | 0.78 | CSNK1D (0.30) | — | |
| SCHEMBL22718582 | 0.76 | GRM5 (0.35) | — | |
| SCHEMBL16699916 | 0.70 | CSNK1E (0.44) | — | |
| SCHEMBL22718630 | 0.68 | NR1H2 (0.36) | — | |
| SCHEMBL30622755 | 0.68 | GRM5 (0.39) | — | |
| SCHEMBL23705926 | 0.68 | DRD2 (0.39) | — | |
| SCHEMBL26645527 | 0.67 | CSNK1E (0.41) | — | |
| SCHEMBL28785443 | 0.66 | GRM5 (0.47) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220153754-A1 | FUSED HETEROCYCLE DERIVATIVES AS CAPSID ASSEMBLY MODULATORS | Janssen Sciences Ireland Unlimited Company (IE) | 2022-05-19 | — | — | US | disclosed |
| EP-3976619-A1 | FUSED HETEROCYCLE DERIVATIVES AS CAPSID ASSEMBLY MODULATORS | Janssen Sciences Ireland Unlimited Company (IE) | 2022-04-06 | — | — | EP | disclosed |
| CN-113906030-A | Fused heterocyclic derivatives | 爱尔兰詹森科学公司 | 2022-01-07 | — | — | CN | disclosed |
| CN-113906031-A | Fused heterocyclic derivatives as capsid assembly modulators | 爱尔兰詹森科学公司 | 2022-01-07 | — | — | CN | disclosed |
| WO-2020239864-A1 | FUSED HETEROCYCLE DERIVATIVES AS CAPSID ASSEMBLY MODULATORS | Janssen Sciences Ireland Unlimited Company (IE) | 2020-12-03 | — | — | WO | disclosed |
| WO-2020243153-A1 | FUSED HETEROCYCLIC DERIVATIVES | Janssen Sciences Ireland Unlimited Company (IE) | 2020-12-03 | — | — | WO | disclosed |