Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.34 |
| ▸ | DHFR | P00374 | 4/20 | 0.34 |
| ▸ | DCPS | Q96C86 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28802703 | 1.00 | TLR8 (0.34) | TLR8DHFRDCPSNOS3NOS1 | |
| SCHEMBL213846 | 0.80 | DHFR (0.46) | TLR8DHFRDCPS | |
| SCHEMBL30947352 | 0.75 | APP (0.47) | — | |
| SCHEMBL29809266 | 0.73 | HTT (0.41) | TLR8NOS3NOS1 | |
| SCHEMBL28802745 | 0.73 | HTT (0.41) | TLR8NOS3NOS1 | |
| SCHEMBL14433569 | 0.69 | PRMT6 (0.42) | — | |
| SCHEMBL5456922 | 0.67 | TLR8 (0.46) | TLR8DHFR | |
| SCHEMBL841926 | 0.67 | ACHE (0.53) | — | |
| SCHEMBL842173 | 0.66 | KCNH2 (0.39) | DHFRKCNH2 | |
| SCHEMBL3961169 | 0.66 | DHFR (0.38) | DHFR |
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 |
|---|---|---|---|---|---|---|---|
| CN-114805341-B | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-114805341-A | Aromatic heterocyclic compounds and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-07-29 | — | — | CN | disclosed |