Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21855347 | 0.79 | ESR1 (0.43) | ARALDH1A1 | |
| SCHEMBL24743717 | 0.77 | AR (0.34) | ARHPGDMAOB | |
| SCHEMBL24743689 | 0.74 | AR (0.43) | ARHPGD | |
| SCHEMBL21855306 | 0.74 | ESR1 (0.43) | ARALDH1A1 | |
| SCHEMBL24744295 | 0.73 | AR (0.33) | ARHPGD | |
| SCHEMBL24745983 | 0.72 | PLAU (0.54) | HPGDALDH1A1POLB | |
| SCHEMBL30164630 | 0.72 | HPGD (0.40) | ARHPGDALDH1A1POLB | |
| SCHEMBL24744288 | 0.72 | HPGD (0.40) | ARHPGDALDH1A1POLB | |
| SCHEMBL15958533 | 0.72 | MCL1 (0.39) | ARHPGDMCL1NPC1ALDH1A1 | |
| SCHEMBL15713088 | 0.71 | MAPT (0.41) | HPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022111526-A1 | BENZENE RING DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF | 四川海思科制药有限公司 | 2022-06-02 | — | — | WO | disclosed |