Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.50 |
| ▸ | CDC7 | O00311 | 4/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.41 |
| ▸ | GSK3B | P49841 | 5/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 4/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | CHUK | O15111 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | PRKCG | P05129 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 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 | |
|---|---|---|---|---|
| SCHEMBL25260165 | 1.00 | HDAC6 (0.50) | HDAC6CDC7ROCK2GSK3BTP53 | |
| SCHEMBL25214498 | 0.93 | HDAC6 (0.50) | HDAC6CDC7ROCK2GSK3BTP53 | |
| SCHEMBL25267504 | 0.87 | HDAC6 (0.51) | HDAC6CDC7ROCK2GSK3BTP53 | |
| SCHEMBL25215233 | 0.84 | HDAC6 (0.52) | HDAC6CDC7ROCK2GSK3BFLT3 | |
| SCHEMBL30424426 | 0.84 | HDAC6 (0.52) | HDAC6CDC7ROCK2GSK3BFLT3 | |
| SCHEMBL25355437 | 0.81 | HDAC6 (0.52) | HDAC6CDC7KDRHDAC1NAMPT | |
| SCHEMBL25351569 | 0.79 | HDAC6 (0.55) | HDAC6CDC7ROCK2GSK3BPIM1 | |
| SCHEMBL25350232 | 0.79 | HDAC6 (0.57) | HDAC6CDC7ROCK2GSK3BPIM1 | |
| SCHEMBL24215731 | 0.78 | HDAC6 (0.50) | HDAC6CDC7ROCK2GSK3BFLT3 | |
| SCHEMBL30409172 | 0.78 | HDAC6 (0.50) | HDAC6CDC7ROCK2GSK3BFLT3 |
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-116157398-B | Oxadiazole-based selective histone deacetylase 6 inhibitors | 意大发马克股份公司 | 2025-03-11 | — | — | CN | disclosed |
| CN-116157398-A | 2- (4- ((5- (benzo [ b ] thiophen-3-yl) -1H-tetrazol-1-yl) methyl) phenyl) -5- (difluoromethyl) -1,3, 4-oxadiazole derivatives and similar compounds as selective inhibitors of histone deacetylase 6 (HDAC 6) for the treatment of, for example, peripheral neuropathy | 意大发马克股份公司 | 2023-05-23 | — | — | CN | disclosed |