Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 3/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31728545 | 0.81 | DGAT1 (0.39) | DGAT1MAP4K4CYP2D6MAOAMAPK1 | |
| SCHEMBL31728885 | 0.72 | CNR2 (0.40) | DGAT1MAP4K4CNR2CNR1CYP2D6 | |
| SCHEMBL31727770 | 0.70 | PTPN11 (0.39) | DGAT1PTPN11 | |
| SCHEMBL31727897 | 0.68 | LIMK1 (0.36) | MAP4K4CNR2KDM4EALDH1A1MAPT | |
| SCHEMBL31728633 | 0.68 | MAP4K4 (0.41) | DGAT1MAP4K4CYP2D6MAOAMAPK1 | |
| SCHEMBL31727873 | 0.68 | SMN1; SMN2 (0.40) | DGAT1MAP4K4CYP2D6MAOAMAPK1 | |
| SCHEMBL31728484 | 0.67 | PDE5A (0.46) | MAP4K4CYP2D6MAPK1KDM4EALDH1A1 | |
| SCHEMBL15587639 | 0.66 | MAP4K4 (0.57) | DGAT1MAP4K4NSD2NSD3CSNK1A1 | |
| SCHEMBL24183387 | 0.65 | CYP2D6 (0.50) | CYP2D6MAOAMAPK1ADRA1ASCN4A | |
| SCHEMBL29770983 | 0.65 | ALOX15 (0.45) | CNR2CNR1PTPN11KDM4EALDH1A1 |
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 |