Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 3/20 | 0.35 |
| ▸ | PDE2A | O00408 | 6/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL6670396 | 0.82 | HCAR2 (0.37) | KDM4EALDH1A1HPGDSMN1; SMN2CYP19A1 | |
| SCHEMBL25329522 | 0.73 | NQO2 (0.46) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL26550995 | 0.71 | PDE3B (0.46) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL1381227 | 0.69 | KDM4E (0.51) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL15825041 | 0.69 | NQO2 (0.56) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| Hydrochloric Acid SCHEMBL7516809 | 0.68 | KDM4E (0.50) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL25647633 | 0.66 | NQO2 (0.45) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL6671371 | 0.65 | NQO2 (0.56) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL6674677 | 0.64 | NQO2 (0.54) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 | |
| SCHEMBL6672275 | 0.64 | CYP19A1 (0.46) | KDM4EALDH1A1HPGDSMN1; SMN2NQO2 |
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-1401830-A2 | QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS | Warner-Lambert Company LLC (US) | 2004-03-31 | — | — | EP | disclosed |
| WO-2002102793-A2 | QUINAZOLINEDIONES AS ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2002-12-27 | — | — | WO | disclosed |