Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | BTK | Q06187 | 4/20 | 0.33 |
| ▸ | JAK2 | O60674 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26607353 | 1.00 | PARP1 (0.35) | PARP1BRD4BTKJAK2KDM4E | |
| SCHEMBL26606985 | 0.83 | BTK (0.38) | PARP1BRD4BTKJAK2 | |
| SCHEMBL26606968 | 0.82 | JAK2 (0.31) | JAK2 | |
| SCHEMBL26607338 | 0.81 | — | — | |
| SCHEMBL26725109 | 0.79 | CHEK1 (0.36) | PARP1 | |
| SCHEMBL30572985 | 0.78 | PIK3CD (0.30) | — | |
| SCHEMBL26607212 | 0.78 | PIK3CD (0.30) | — | |
| SCHEMBL26606914 | 0.77 | ABL1 (0.32) | — | |
| SCHEMBL26607210 | 0.77 | F2 (0.31) | — | |
| SCHEMBL26601773 | 0.77 | ADRA1D (0.32) | BTKJAK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4511114-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | Vertex Pharmaceuticals Incorporated (US) | 2025-02-26 | — | — | EP | disclosed |
| WO-2023205778-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-10-26 | — | — | WO | disclosed |