Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 5/20 | 0.33 |
| ▸ | ABL1 | P00519 | 4/20 | 0.32 |
| ▸ | EGFR | P00533 | 4/20 | 0.32 |
| ▸ | HCK | P08631 | 4/20 | 0.32 |
| ▸ | SRC | P12931 | 4/20 | 0.32 |
| ▸ | KDR | P35968 | 4/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 4/20 | 0.32 |
| ▸ | MTOR | P42345 | 4/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.32 |
| ▸ | EPHB4 | P54760 | 4/20 | 0.32 |
| ▸ | PRKDC | P78527 | 4/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.32 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR7 | P34969 | 1/20 | 0.30 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL31728775 | 0.91 | SRC (0.36) | METABL1EGFRHCKSRC | |
| SCHEMBL31728436 | 0.90 | PIK3CD (0.37) | METABL1EGFRHCKSRC | |
| SCHEMBL31729300 | 0.83 | MET (0.35) | METABL1EGFRHCKSRC | |
| SCHEMBL31727749 | 0.81 | SRC (0.36) | METABL1EGFRHCKSRC | |
| SCHEMBL31728933 | 0.80 | PIK3CD (0.31) | ABL1EGFRHCKSRCKDR | |
| SCHEMBL31728408 | 0.78 | PIK3CD (0.30) | ABL1EGFRHCKSRCKDR | |
| SCHEMBL31727950 | 0.78 | MET (0.33) | METABL1EGFRHCKSRC | |
| SCHEMBL31728112 | 0.78 | MET (0.33) | METABL1EGFRHCKSRC | |
| SCHEMBL31728243 | 0.78 | MET (0.34) | METABL1EGFRHCKSRC | |
| SCHEMBL31727822 | 0.74 | EIF2AK3 (0.31) | HTR1ADRD2HTR7HTR6EIF2AK3 |
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 |