Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 9/20 | 0.50 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.46 |
| ▸ | CLK1 | P49759 | 2/20 | 0.45 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | ABL2 | P42684 | 1/20 | 0.42 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31727973 | 0.82 | MAP4K4 (0.45) | MAP4K4LIMK1CLK1DHFRABL1 | |
| SCHEMBL31728376 | 0.81 | MAP4K4 (0.53) | MAP4K4LIMK1CLK1DHFRABL1 | |
| SCHEMBL31727856 | 0.81 | MAP4K4 (0.53) | MAP4K4LIMK1CLK1FYNDHFR | |
| SCHEMBL31727817 | 0.75 | FYN (0.48) | MAP4K4LIMK1CLK1PDE5AFYN | |
| SCHEMBL31728130 | 0.75 | SRC (0.45) | MAP4K4LIMK1CLK1PDE5AFYN | |
| SCHEMBL31727955 | 0.73 | MAP4K4 (0.45) | MAP4K4LIMK1CLK1DHFRABL1 | |
| SCHEMBL31727887 | 0.72 | STK4 (0.53) | MAP4K4LIMK1CLK1FYNPDE2A | |
| SCHEMBL31728471 | 0.70 | MAP4K4 (0.53) | MAP4K4LIMK1CLK1DHFRABL1 | |
| SCHEMBL31728198 | 0.70 | PDE5A (0.53) | MAP4K4LIMK1CLK1PDE5AFYN | |
| SCHEMBL31728078 | 0.70 | CLK1 (0.48) | MAP4K4LIMK1CLK1PDE5AFYN |
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 |