Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 6/20 | 0.37 |
| ▸ | ABL1 | P00519 | 4/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
| ▸ | ABL2 | P42684 | 1/20 | 0.37 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 2/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.32 |
| ▸ | PRKDC | P78527 | 2/20 | 0.32 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | HCK | P08631 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.31 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31727826 | 0.91 | SRC (0.36) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31727872 | 0.89 | SRC (0.35) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31728979 | 0.87 | SRC (0.39) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31728350 | 0.87 | SRC (0.39) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31727824 | 0.85 | EGFR (0.33) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31728749 | 0.78 | PIK3CD (0.30) | SRCABL1EGFRKDRPIK3CD | |
| SCHEMBL31728130 | 0.77 | SRC (0.45) | SRCABL1EGFRKDRABL2 | |
| SCHEMBL31728340 | 0.76 | SRC (0.33) | SRCABL1EGFRKDRPIK3CD | |
| SCHEMBL31728368 | 0.75 | — | — | |
| SCHEMBL31728341 | 0.75 | SRC (0.34) | SRCABL1EGFRKDRPIK3CD |
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 |