Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5103338 | 0.82 | NQO1 (0.52) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL9286035 | 0.82 | NQO1 (0.53) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL2358729 | 0.81 | LMNA (0.48) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL1649890 | 0.79 | NQO1 (0.50) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL7354341 | 0.77 | KDM4E (0.55) | NQO1CYP2C9KDM4ELMNAALDH1A1 | |
| SCHEMBL12747979 | 0.73 | KDM4E (0.62) | NQO1CYP2C9KDM4ELMNAALDH1A1 | |
| SCHEMBL15514111 | 0.72 | ALDH1A1 (0.51) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL3778823 | 0.72 | ALDH1A1 (0.51) | NQO1CYP2C9KDM4ELMNAHTT | |
| SCHEMBL7351830 | 0.72 | ALDH1A1 (0.50) | NQO1CYP2C9KDM4ELMNAALDH1A1 | |
| SCHEMBL1095043 | 0.70 | KDM4E (0.57) | NQO1CYP2C9KDM4ELMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0682663-A1 | 4-HYDROXY-BENZOPYRAN-2-ONES AND 4-HYDROXY-CYCLOALKYL B]PYRAN-2-ONES USEFUL TO TREAT RETROVIRAL INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-22 | — | — | EP | disclosed |