Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | GPR183 | P32249 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.35 |
| ▸ | APLNR | P35414 | 2/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | KIF5B | P33176 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1428556 | 1.00 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1GPR183NFE2L2 | |
| SCHEMBL1428554 | 1.00 | CYP1A1 (0.40) | CYP1A1CYP1A2CYP1B1GPR183NFE2L2 | |
| SCHEMBL1276360 | 0.85 | NFE2L2 (0.39) | GPR183NFE2L2ALDH1A1MAPTAMY1A | |
| SCHEMBL2142490 | 0.85 | NFE2L2 (0.39) | GPR183NFE2L2ALDH1A1MAPTAMY1A | |
| SCHEMBL21352123 | 0.81 | APLNR (0.36) | CYP1A1CYP1A2CYP1B1GPR183APLNR | |
| SCHEMBL12732543 | 0.79 | GPR183 (0.39) | CYP1A1CYP1A2CYP1B1GPR183NFE2L2 | |
| SCHEMBL31573785 | 0.78 | APP (0.37) | — | |
| SCHEMBL31573606 | 0.78 | APP (0.37) | — | |
| SCHEMBL31573688 | 0.78 | APP (0.37) | — | |
| SCHEMBL23888923 | 0.77 | CYP1A1 (0.37) | CYP1A1CYP1A2CYP1B1GPR183NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4737437-A1 | DPP1 INHIBITOR INTERMEDIATE, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINES | Haisco Pharmaceuticals Pte. Ltd. (SG) | 2026-05-06 | — | — | EP | disclosed |
| WO-2025002093-A1 | DPP1 INHIBITOR INTERMEDIATE, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINES | 西藏海思科制药有限公司 | 2025-01-02 | — | — | WO | disclosed |