Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | DGAT1 | O75907 | 6/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31727998 | 0.83 | MAP4K4 (0.49) | CNR2DGAT1PTPN11MAP4K4 | |
| SCHEMBL31728568 | 0.81 | DGAT1 (0.41) | CNR2DGAT1PTPN11MAP4K4 | |
| SCHEMBL31729239 | 0.79 | CNR2 (0.53) | CNR2DGAT1ALDH1A1PTPN11 | |
| SCHEMBL31729200 | 0.79 | DGAT1 (0.39) | DGAT1PTPN11 | |
| SCHEMBL31729246 | 0.79 | DGAT1 (0.39) | CNR2DGAT1PTPN11 | |
| SCHEMBL31728894 | 0.77 | PTPN11 (0.41) | CNR2DGAT1PTPN11 | |
| SCHEMBL31729125 | 0.75 | DGAT1 (0.38) | DGAT1CYP2D6PTPN11 | |
| SCHEMBL31728779 | 0.74 | NOTUM (0.43) | DGAT1 | |
| SCHEMBL31728633 | 0.74 | MAP4K4 (0.41) | DGAT1CYP2D6MAP4K4 | |
| SCHEMBL31727873 | 0.74 | SMN1; SMN2 (0.40) | DGAT1CYP2D6SMN1; SMN2PTPN11MAP4K4 |
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 |