Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TACR2 | P21452 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL31314242 | 1.00 | DHFR (0.36) | DHFRALDH1A1KDM4ETACR2ALDH1A3 | |
| SCHEMBL25862575 | 0.88 | TACR2 (0.38) | DHFRALDH1A1KDM4ETACR2ALDH1A3 | |
| SCHEMBL25862541 | 0.86 | ALDH1A1 (0.34) | ALDH1A1KDM4ETACR2ALDH1A3FDPS | |
| SCHEMBL31314299 | 0.82 | GABRG2 (0.31) | — | |
| SCHEMBL25857192 | 0.81 | DHFR (0.37) | DHFRALDH1A1KDM4ETACR2FDPS | |
| SCHEMBL31314084 | 0.81 | ALDH1A1 (0.39) | DHFRALDH1A1KDM4ETACR2FDPS | |
| SCHEMBL25859343 | 0.81 | ALDH1A1 (0.39) | DHFRALDH1A1KDM4ETACR2FDPS | |
| SCHEMBL25858440 | 0.80 | ALDH1A1 (0.35) | DHFRALDH1A1KDM4ETACR2FDPS | |
| SCHEMBL25862807 | 0.79 | CACNA2D1 (0.44) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL25302462 | 0.78 | NLRP3 (0.54) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025036275-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USE THEREOF | 药捷安康(南京)科技股份有限公司 | 2025-02-20 | — | — | WO | disclosed |
| WO-2023131277-A1 | NLRP3 INFLAMMASOME INHIBITOR AND USES THEREOF | 药捷安康(南京)科技股份有限公司 | 2023-07-13 | — | — | WO | disclosed |