Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.71 |
| ▸ | MEN1 | O00255 | 6/20 | 0.71 |
| ▸ | CASP6 | P55212 | 2/20 | 0.71 |
| ▸ | APAF1 | O14727 | 3/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | MAPT | P10636 | 3/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.53 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 2/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.52 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.52 |
| ▸ | MDH2 | P40926 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29609544 | 0.83 | KMT2A (1.00) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL2586644 | 0.83 | KMT2A (1.00) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL8207403 | 0.80 | KMT2A (0.63) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL28350022 | 0.79 | KMT2A (0.65) | KMT2AMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL30378020 | 0.79 | KMT2A (0.65) | KMT2AMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL2023150 | 0.77 | GRM5 (0.50) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL1260656 | 0.75 | KMT2A (0.45) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL9918982 | 0.72 | SRD5A1 (0.50) | KMT2AMEN1CASP6GAA | |
| SCHEMBL5807332 | 0.72 | KMT2A (0.59) | KMT2AMEN1CASP6APAF1ALDH1A1 | |
| SCHEMBL29648466 | 0.72 | ALDH1A1 (0.78) | CASP6APAF1ALDH1A1MAPTCASP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5741798-A | 2-benzyl-4-sulfonyl-4H-isoquinolin-1,3-diones and their use as antiinflammatory agents | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1998-04-21 | — | — | US | disclosed |
| WO-1997046532-A1 | 2-BENZYL-4-SULFONYL-4H-ISOQUINOLIN-1,3-DIONES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1997-12-11 | — | — | WO | disclosed |