Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 6/20 | 0.37 |
| ▸ | KDR | P35968 | 5/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.37 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.37 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 2/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.37 |
| ▸ | RET | P07949 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.37 |
| ▸ | CLK2 | P49760 | 2/20 | 0.37 |
| ▸ | GSK3A | P49840 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.37 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.37 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16712833 | 0.84 | MAP4K4 (0.41) | MAP4K4KDRAURKBDYRK3CSNK1D | |
| SCHEMBL31727757 | 0.78 | SMN1; SMN2 (0.34) | KMT2AALDH1A1MAPTADORA2AADORA1 | |
| SCHEMBL24399770 | 0.78 | NQO2 (0.31) | — | |
| SCHEMBL31728569 | 0.74 | NQO2 (0.44) | KDRLIMK1EPHB4MTORABL1 | |
| SCHEMBL31728816 | 0.70 | KDR (0.37) | MAP4K4KDRAURKBDYRK3CSNK1D | |
| SCHEMBL30775557 | 0.70 | MAP4K4 (0.40) | MAP4K4KDRMINK1NSD2EPHB4 | |
| SCHEMBL31729179 | 0.70 | MAP4K4 (0.41) | MAP4K4KDRAURKBAURKADAPK3 | |
| SCHEMBL31728534 | 0.70 | PDE5A (0.44) | MAP4K4KDRAURKBDYRK3CSNK1D | |
| SCHEMBL31729158 | 0.70 | PIK3CD (0.37) | MAP4K4KDRAURKBDYRK3CSNK1D | |
| SCHEMBL31727913 | 0.67 | PDE5A (0.37) | MAP4K4KDRAURKBDYRK3CSNK1D |
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 |