Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | DDO | Q99489 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30366533 | 0.78 | L3MBTL1 (0.48) | GABRA1GABRB2ADRA2AADRA2BADRA2C | |
| SCHEMBL2126532 | 0.78 | L3MBTL1 (0.48) | GABRA1GABRB2ADRA2AADRA2BADRA2C | |
| SCHEMBL11092148 | 0.78 | GABRA1 (0.42) | GABRA1GABRB2NLRP3TP53MAPT | |
| SCHEMBL28256344 | 0.77 | GABRA1 (0.30) | GABRA1GABRB2 | |
| SCHEMBL11520376 | 0.76 | GABRA1 (0.54) | GABRA1GABRB2ADRA2AADRA2BADRA2C | |
| SCHEMBL8400023 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL29172593 | 0.76 | PTGS2 (0.39) | LIPGMAPT | |
| SCHEMBL4859506 | 0.75 | ALDH1A1 (0.46) | L3MBTL1TSHR | |
| SCHEMBL11361204 | 0.75 | GABRA1 (0.52) | GABRA1GABRB2ADRA2AADRA2BADRA2C | |
| SCHEMBL30688760 | 0.75 | GABRA1 (0.39) | GABRA1GABRB2MAPTNPSR1L3MBTL1 |
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-2025124544-A1 | 3,4-DIHYDRO-2H-BENZO[B][1,4]DIOXEPANE COMPOUND, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF | 华润医药研究院（深圳）有限公司 | 2025-06-19 | — | — | WO | disclosed |