Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 4/20 | 0.37 |
| ▸ | ABL1 | P00519 | 5/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.35 |
| ▸ | HCK | P08631 | 3/20 | 0.35 |
| ▸ | SRC | P12931 | 3/20 | 0.35 |
| ▸ | KDR | P35968 | 3/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.35 |
| ▸ | MTOR | P42345 | 3/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 3/20 | 0.35 |
| ▸ | PRKDC | P78527 | 3/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.35 |
| ▸ | EIF2AK3 | Q9NZJ5 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31728875 | 0.90 | SLC6A4 (0.38) | ALOX5APFEN1EGFRABL1ATR | |
| SCHEMBL31727899 | 0.84 | PIK3CD (0.31) | EGFRABL1PIK3CDHCKSRC | |
| SCHEMBL31728533 | 0.79 | GPR119 (0.44) | EGFRPIK3CDSRCKDR | |
| SCHEMBL31729251 | 0.78 | EGFR (0.48) | EGFR | |
| SCHEMBL31728720 | 0.77 | PIK3CD (0.38) | ALOX5APFEN1EGFRABL1PIK3CD | |
| SCHEMBL31728432 | 0.76 | ERBB2 (0.30) | KDREPHB4 | |
| SCHEMBL31728366 | 0.76 | ERBB2 (0.30) | KDREPHB4 | |
| SCHEMBL31727874 | 0.75 | CLK1 (0.38) | EGFRABL1PIK3CDHCKSRC | |
| SCHEMBL31728571 | 0.74 | MET (0.35) | JAK2ALK | |
| SCHEMBL31729165 | 0.74 | MET (0.35) | JAK2ALK |
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-2025235874-A1 | HETEROCYCLICS AS EGFR INHIBITORS | SCHRÖDINGER, INC. (US) | 2025-11-13 | — | — | WO | disclosed |