Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 10/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31729239 | 0.89 | CNR2 (0.53) | CNR2DGAT1PTPN11 | |
| SCHEMBL31728894 | 0.84 | PTPN11 (0.41) | CNR2DGAT1PTPN11 | |
| SCHEMBL31728602 | 0.83 | CNR2 (0.49) | MAP4K4CNR2DGAT1PTPN11 | |
| SCHEMBL31729125 | 0.79 | DGAT1 (0.38) | DGAT1PTPN11 | |
| SCHEMBL31728779 | 0.78 | NOTUM (0.43) | DGAT1 | |
| SCHEMBL31728080 | 0.78 | NOTUM (0.39) | DGAT1 | |
| SCHEMBL31727873 | 0.77 | SMN1; SMN2 (0.40) | MAP4K4DGAT1PTPN11 | |
| SCHEMBL31728633 | 0.77 | MAP4K4 (0.41) | MAP4K4DGAT1 | |
| SCHEMBL31728357 | 0.77 | PIK3C3 (0.47) | CNR2DGAT1 | |
| SCHEMBL31728863 | 0.74 | DGAT1 (0.39) | MAP4K4DGAT1PTPN11 |
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 |