Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL29123398 | 0.88 | MAOB (0.37) | ADORA2AMAOB | |
| SCHEMBL29122705 | 0.85 | MAOB (0.37) | ADORA2AMAOB | |
| SCHEMBL30525252 | 0.85 | ADORA2A (0.45) | ADORA2A | |
| SCHEMBL30525245 | 0.83 | MDM2 (0.44) | — | |
| SCHEMBL30525256 | 0.82 | MAOB (0.40) | MAOB | |
| SCHEMBL30525239 | 0.81 | MAOB (0.36) | MAOB | |
| SCHEMBL30525257 | 0.80 | MAOB (0.37) | MAOB | |
| SCHEMBL29122912 | 0.77 | MAOB (0.41) | MAOB | |
| SCHEMBL29122623 | 0.76 | CYP1A2 (0.39) | ADORA2AMAOB | |
| SCHEMBL29123169 | 0.76 | TP53 (0.50) | ADORA2AMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-116535397-A | Isobenzofuran-1 (3H) -one compound, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-08-04 | — | — | CN | disclosed |