Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GPR6 | P46095 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | POLQ | O75417 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1208389 | 0.85 | LMNA (0.45) | LDHAIRAK4POLBALDH1A1KDM4E | |
| SCHEMBL1210211 | 0.83 | IRAK4 (0.43) | LDHAIRAK4NLRP3POLBMGLL | |
| SCHEMBL1211214 | 0.81 | IRAK4 (0.42) | LDHAIRAK4NLRP3POLBMGLL | |
| SCHEMBL1207841 | 0.81 | IRAK4 (0.44) | LDHAIRAK4NLRP3MGLLHPGD | |
| SCHEMBL1207843 | 0.81 | LDHA (0.43) | LDHAIRAK4DRD3NLRP3MGLL | |
| SCHEMBL30305820 | 0.80 | IRAK4 (0.41) | LDHAIRAK4NLRP3MGLLNPC1 | |
| SCHEMBL14695679 | 0.77 | IRAK4 (0.39) | LDHAIRAK4NLRP3MGLLGPR6 | |
| SCHEMBL22712230 | 0.77 | IRAK4 (0.39) | LDHAIRAK4NLRP3POLBMGLL | |
| SCHEMBL30305933 | 0.77 | IRAK4 (0.39) | LDHAIRAK4NLRP3MGLLGPR6 | |
| SCHEMBL18421502 | 0.75 | RAB9A (0.43) | ALDH1A1KDM4EHPGDHSD17B10KMT2A |
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 |