Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | VEGFA | P15692 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL26962120 | 0.87 | JAK2 (0.34) | SMN1; SMN2JAK2JAK1TBK1PDK2 | |
| SCHEMBL26961929 | 0.86 | PDK2 (0.34) | SMN1; SMN2PDK2THRBGPR119 | |
| SCHEMBL26962286 | 0.85 | TRPC3 (0.36) | SMN1; SMN2THRBGPR119CNR1CNR2 | |
| SCHEMBL26961932 | 0.84 | NPY1R (0.32) | PDK2CNR2LMNAUSP2HSD17B10 | |
| SCHEMBL26962142 | 0.84 | HSD17B10 (0.33) | PDK2THRBUSP2HSD17B10 | |
| SCHEMBL26962164 | 0.83 | PDK2 (0.33) | SMN1; SMN2PDK2LMNAUSP2HSD17B10 | |
| SCHEMBL26961749 | 0.81 | AKT1 (0.33) | THRBLMNAUSP2HSD17B10 | |
| SCHEMBL26961719 | 0.80 | KDM4E (0.32) | USP2HSD17B10 | |
| SCHEMBL26962012 | 0.80 | PDK2 (0.30) | PDK2 | |
| SCHEMBL26961699 | 0.79 | RIPK1 (0.38) | MEN1USP2KMT2AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4291558-A1 | BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER | F. Hoffmann-La Roche AG (CH) | 2023-12-20 | — | — | EP | disclosed |