Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21952429 | 0.62 | CES1 (0.67) | CES1PTPRCPABPC1DNMT1 | |
| SCHEMBL3639125 | 0.61 | — | — | |
| SCHEMBL30448645 | 0.59 | CES1 (1.00) | CES1PTPRCPABPC1DNMT1 | |
| SCHEMBL22733886 | 0.58 | CES1 (0.52) | CES1PTPRCPABPC1DNMT1 | |
| SCHEMBL29915354 | 0.56 | CES1 (0.71) | CES1PTPRCPABPC1DNMT1 | |
| Water SCHEMBL27431967 | 0.56 | PNMT (0.31) | CES1 | |
| SCHEMBL8760169 | 0.56 | — | — | |
| SCHEMBL22270138 | 0.55 | PTPRC (0.50) | CES1PTPRCPABPC1DNMT1 | |
| SCHEMBL13720094 | 0.55 | — | — | |
| SCHEMBL7168835 | 0.55 | — | — |
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-113549049-B | Polysubstituted thienocyclopentanone derivative and synthetic method thereof | 中国科学院大连化学物理研究所 | 2022-04-15 | — | — | CN | disclosed |
| CN-113549049-A | Polysubstituted thienocyclopentanone derivative and synthetic method thereof | 中国科学院大连化学物理研究所 | 2021-10-26 | — | — | CN | disclosed |