Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | IDH1 | O75874 | 2/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16623538 | 0.88 | JAK1 (0.31) | BRD4JAK1 | |
| SCHEMBL16623464 | 0.88 | JAK1 (0.38) | BRD4JAK1 | |
| SCHEMBL16623542 | 0.86 | JAK1 (0.39) | BRD4JAK1 | |
| SCHEMBL16623488 | 0.86 | JAK1 (0.33) | JAK1 | |
| SCHEMBL16623501 | 0.85 | JAK1 (0.34) | BRD4JAK1 | |
| SCHEMBL16623582 | 0.85 | JAK1 (0.33) | JAK1 | |
| SCHEMBL16623595 | 0.85 | CNR1 (0.34) | JAK1 | |
| SCHEMBL16623512 | 0.84 | JAK1 (0.43) | BRD4JAK1 | |
| SCHEMBL16623576 | 0.83 | HPGDS (0.35) | BRD4IDH1JAK1 | |
| SCHEMBL16623581 | 0.80 | JAK2 (0.37) | BRD4JAK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| US-9371320-B2 | Heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2016-06-21 | — | — | US | disclosed |
| EP-2857400-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2015-04-08 | — | — | EP | disclosed |