Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RAF1 | P04049 | 5/20 | 0.39 |
| ▸ | BRAF | P15056 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6612631 | 0.92 | SCN10A (0.42) | KDM4ESMN1; SMN2LMNAMAPTNPSR1 | |
| SCHEMBL6608517 | 0.92 | SCN10A (0.40) | KDM4ESMN1; SMN2LMNATHRBMAPT | |
| SCHEMBL6435489 | 0.90 | THRB (0.41) | KDM4ESMN1; SMN2LMNATHRBJAK2 | |
| SCHEMBL6163340 | 0.82 | SCN10A (0.37) | SMN1; SMN2THRBJAK3MAPTNPSR1 | |
| SCHEMBL6165622 | 0.82 | SCN10A (0.39) | SMN1; SMN2JAK3MAPTNPSR1 | |
| SCHEMBL6609589 | 0.81 | MAPT (0.38) | KMT2AALDH1A1GAAHPGDMAPT | |
| SCHEMBL6435938 | 0.80 | KDR (0.34) | LMNATHRBJAK2JAK3 | |
| SCHEMBL6610697 | 0.79 | POLB (0.39) | SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL6685456 | 0.79 | CHEK1 (0.38) | KDM4ESMN1; SMN2KMT2AALDH1A1MAPT | |
| SCHEMBL6607218 | 0.78 | BDKRB1 (0.39) | — |
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-1379522-A1 | DIHYDRO-BENZO(b)(1,4)DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083665-A1 | DIHYDRO-BENZO[b][1,4]DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |