Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.76 |
| ▸ | PKM | P14618 | 10/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.67 |
| ▸ | GPR183 | P32249 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28819249 | 0.86 | ALDH1A1 (0.58) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28948647 | 0.82 | PKM (0.76) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28819229 | 0.81 | PKM (0.59) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28819250 | 0.80 | RAB9A (0.54) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28819246 | 0.80 | ALDH1A1 (0.60) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28819242 | 0.78 | LMNA (0.58) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL28819253 | 0.77 | LMNA (0.79) | ALDH1A1PKMSMN1; SMN2GPR183LMNA | |
| SCHEMBL16599355 | 0.74 | GPR183 (1.00) | ALDH1A1PKMGPR183KMT2A | |
| SCHEMBL16599356 | 0.74 | GPR183 (1.00) | ALDH1A1PKMGPR183KMT2A | |
| SCHEMBL24893097 | 0.74 | MEN1 (0.70) | ALDH1A1SMN1; SMN2GPR183LMNAKEAP1 |
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-114634465-B | Pentadienone derivative containing sulfonyl piperazine as well as preparation method and application thereof | 贵州大学 | 2023-05-30 | — | — | CN | disclosed |
| CN-114634465-A | Sulfonyl piperazine-containing pentadiene ketone derivative and preparation method and application thereof | 贵州大学 | 2022-06-17 | — | — | CN | disclosed |