Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1047858 | 0.87 | ALDH1A1 (0.46) | PTPN1CA2PDE4APDE4BPDE4C | |
| SCHEMBL18362599 | 0.80 | PDE4A (0.48) | PTPN1CA2PDE4APDE4BPDE4C | |
| SCHEMBL23783141 | 0.77 | ERN1 (0.44) | CA2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL15702877 | 0.76 | PTPN1 (0.37) | PTPN1CA2PDE4APDE4BPDE4C | |
| SCHEMBL9198298 | 0.75 | USP2 (0.44) | PTPN1CA2CA12CA1CA7 | |
| SCHEMBL12404016 | 0.74 | PDE4A (0.47) | CA2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17323226 | 0.74 | PDE4A (0.47) | PTPN1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL9349868 | 0.74 | CRHR1 (0.35) | PTPN1CA2CA12CA1CA7 | |
| SCHEMBL2096172 | 0.73 | ALDH1A1 (0.50) | PTPN1CA2CA12CA1CA7 | |
| SCHEMBL16096690 | 0.73 | POLB (0.38) | CA2PDE4APDE4BPDE4CPDE4D |
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-111902400-B | Aromatic derivatives, process for their preparation and their medical use | 保仕健生物科技(上海)有限公司 | 2024-08-30 | — | — | CN | disclosed |
| CN-111902400-A | Aromatic derivatives, process for their preparation and their medical use | 保仕健生物科技(上海)有限公司 | 2020-11-06 | — | — | CN | disclosed |