Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 4/20 | 0.32 |
| ▸ | EIF4E | P06730 | 1/20 | 0.31 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.30 |
| ▸ | FFAR2 | O15552 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31727905 | 0.80 | TBK1 (0.32) | KDRSRC | |
| SCHEMBL31727943 | 0.78 | PIK3CD (0.35) | KDREPHB4SRCEGFR | |
| SCHEMBL31728767 | 0.77 | PIK3CD (0.41) | KDRERBB2EPHB4SRCEGFR | |
| SCHEMBL31728916 | 0.75 | PDE5A (0.33) | KDREPHB4SRCEGFR | |
| SCHEMBL31728447 | 0.73 | EGFR (0.30) | KDRERBB2EGFR | |
| SCHEMBL31727802 | 0.71 | SRC (0.34) | KDREPHB4SRCEGFR | |
| SCHEMBL31727748 | 0.71 | ABL1 (0.31) | KDREPHB4SRCEGFR | |
| SCHEMBL31728531 | 0.69 | — | — | |
| SCHEMBL31729146 | 0.66 | PIK3CD (0.36) | KDRERBB2EPHB4SRCEGFR | |
| SCHEMBL31728572 | 0.64 | — | — |
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 |