Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.72 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.52 |
| ▸ | HTR3A | P46098 | 1/20 | 0.52 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.52 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.49 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4602203 | 0.96 | ALDH1A1 (0.78) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL28613806 | 0.90 | SMN1; SMN2 (0.64) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL28893940 | 0.84 | ALDH1A1 (0.52) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL2747664 | 0.84 | ALDH1A1 (1.00) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL1697463 | 0.84 | ALDH1A1 (1.00) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL5259296 | 0.84 | ALDH1A1 (1.00) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL1697444 | 0.81 | ALDH1A1 (0.78) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL11196778 | 0.80 | SMN1; SMN2 (0.55) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 | |
| SCHEMBL11337356 | 0.80 | PREP (0.60) | SMN1; SMN2NPSR1L3MBTL1SPHK2SPHK1 | |
| SCHEMBL6161213 | 0.79 | ALDH1A1 (0.62) | SMN1; SMN2ALDH1A1MAPK1KDM4ENPSR1 |
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-115210233-A | 1,3, 4-oxadiazole derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions comprising the same | 株式会社钟根堂 | 2022-10-18 | — | — | CN | disclosed |
| CN-108026056-B | 1,3, 4-oxadiazole amide derivative compounds as histone deacetylase 6 inhibitors and pharmaceutical compositions thereof | 株式会社钟根堂 | 2021-08-03 | — | — | CN | disclosed |