Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19789724 | 0.91 | MEN1 (0.39) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL13620463 | 0.91 | MEN1 (0.39) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL19789886 | 0.84 | ALDH1A1 (0.41) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL19789877 | 0.82 | LMNA (0.35) | POLBALDH1A1HPGDCYP1A2CYP2C9 | |
| SCHEMBL19789689 | 0.79 | CES2 (0.42) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL19789758 | 0.78 | CES2 (0.41) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL19789740 | 0.77 | MAPK14 (0.36) | POLBNPC1ALDH1A1CYP2C9LMNA | |
| SCHEMBL12196350 | 0.77 | MEN1 (0.37) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL12196623 | 0.77 | MEN1 (0.37) | MEN1KMT2APOLBNPC1RAB9A | |
| SCHEMBL12196347 | 0.77 | MEN1 (0.37) | MEN1KMT2APOLBNPC1RAB9A |
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-2282991-B1 | METHOD FOR THE PRODUCTION OF 1,4-BENZOTHIEPIN-1,1-DIOXIDE DERIVATIVES | SANOFI AVENTIS DEUTSCHLAND (DE) | 2018-01-24 | — | — | EP | disclosed |