Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | F13A1 | P00488 | 1/20 | 0.35 |
| ▸ | TGM2 | P21980 | 1/20 | 0.35 |
| ▸ | TGM1 | P22735 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31447906 | 0.85 | CCR6 (0.48) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL1896284 | 0.84 | ALDH1A1 (0.40) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL7270408 | 0.81 | CCR6 (0.47) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL30510995 | 0.81 | CCR6 (0.42) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL25346091 | 0.81 | CCR6 (0.42) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL30510994 | 0.80 | L3MBTL1 (0.41) | ALDH1A1BTN3A1CCR6PAX8L3MBTL1 | |
| SCHEMBL4558309 | 0.78 | ALDH1A1 (0.41) | ALDH1A1BTN3A1SMN1; SMN2CCR6PAX8 | |
| SCHEMBL25344309 | 0.78 | L3MBTL1 (0.41) | ALDH1A1BTN3A1CCR6PAX8L3MBTL1 | |
| SCHEMBL31473983 | 0.78 | ALDH1A1 (0.49) | ALDH1A1CCR6PAX8L3MBTL1SIGMAR1 | |
| SCHEMBL5724513 | 0.77 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2CCR6PAX8L3MBTL1 |
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-2025061148-A1 | HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2025-03-27 | — | — | WO | disclosed |