Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.33 |
| ▸ | MET | P08581 | 5/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | TEC | P42680 | 1/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL31728810 | 0.89 | TSHR (0.42) | METFYNSRCTECBTK | |
| SCHEMBL31728213 | 0.80 | EIF2AK3 (0.38) | EGFRFYNSRCTECBTK | |
| SCHEMBL31729172 | 0.76 | MET (0.37) | EGFRMETSRC | |
| SCHEMBL31728243 | 0.76 | MET (0.34) | EGFRMETSRC | |
| SCHEMBL31728762 | 0.75 | ALK (0.39) | METEIF2AK3 | |
| SCHEMBL31729163 | 0.74 | CLK1 (0.37) | EGFRMKNK2SRC | |
| SCHEMBL31728018 | 0.72 | CLK1 (0.36) | EGFRSRCHPGDCYP1A2CYP2C9 | |
| SCHEMBL31728591 | 0.71 | EIF2AK3 (0.39) | EGFRFYNSRCTECBTK | |
| SCHEMBL31728133 | 0.69 | CLK1 (0.36) | EGFRFYNSRCBTKEIF2AK3 | |
| SCHEMBL31728618 | 0.69 | CLK1 (0.36) | EGFRSRCEIF2AK3 |
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 |