Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30125098 | 0.85 | SLC6A3 (0.37) | CCR2SLC6A2SLC6A4HCAR2HSD11B1 | |
| SCHEMBL30124758 | 0.85 | CCR2 (0.35) | CCR2SLC6A2HCAR2CHRNA1CHRNB1 | |
| SCHEMBL29987487 | 0.83 | TSHR (0.31) | — | |
| SCHEMBL30710179 | 0.79 | SLC6A3 (0.35) | CCR2SLC6A2SLC6A4HCAR2HSD11B1 | |
| SCHEMBL30710180 | 0.78 | KMT2A (0.36) | SLC6A2SLC6A4SLC6A3CES2CES1 | |
| SCHEMBL30124933 | 0.76 | HSD11B1 (0.31) | CCR2HSD11B1 | |
| SCHEMBL30124886 | 0.75 | PTPN1 (0.33) | SLC6A2CHRNA1CHRNB1CHRNB2CHRNB4 | |
| SCHEMBL30710190 | 0.74 | CHRNA1 (0.31) | CCR2SLC6A2SLC6A4HSD11B1CHRNA1 | |
| SCHEMBL30124707 | 0.72 | PKM (0.35) | HSD11B1CHRNA1CHRNB1CHRNB2CHRNB4 | |
| SCHEMBL30124913 | 0.72 | CA12 (0.33) | — |
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-115403494-B | Method for synthesizing beta-hydroxy sulfone derivative by oxygen-initiated olefin double-functionalization under mild condition | 湘潭大学 | 2024-01-02 | — | — | CN | disclosed |
| CN-115403494-A | Method for synthesizing beta-hydroxy sulfone derivative through alkene dual functionalization initiated by oxygen under mild condition | 湘潭大学 | 2022-11-29 | — | — | CN | disclosed |