Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL27810301 | 0.78 | ALDH1A1 (0.46) | ALDH1A1MAPTGAALMNASMN1; SMN2 | |
| SCHEMBL3919994 | 0.72 | PKM (0.60) | BRD4ALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL710223 | 0.71 | ALDH1A1 (0.46) | ALDH1A1GAALMNARAB9AL3MBTL1 | |
| SCHEMBL4930161 | 0.71 | PKM (0.62) | ALDH1A1GAAKDM4ELMNASMN1; SMN2 | |
| SCHEMBL29826051 | 0.69 | GAA (0.52) | CYP2C9ALDH1A1MAPTGAAKDM4E | |
| SCHEMBL2112292 | 0.69 | GAA (0.42) | BRD4PNMTCYP2C9ALDH1A1GAA | |
| SCHEMBL708295 | 0.69 | GAA (0.42) | ALDH1A1MAPTGAALMNARAB9A | |
| SCHEMBL30602398 | 0.69 | GAA (0.42) | BRD4PNMTCYP2C9ALDH1A1GAA | |
| SCHEMBL29678127 | 0.69 | GAA (0.42) | ALDH1A1MAPTGAALMNARAB9A | |
| SCHEMBL29131006 | 0.69 | ABL1 (0.37) | ALDH1A1MAPTKDM4EMAPK1TSHR |
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-117069724-A | Fused ring compounds, pharmaceutical compositions and uses | 上海赛默罗德生物科技有限公司 | 2023-11-17 | — | — | CN | disclosed |