Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.34 |
| ▸ | CTSB | P07858 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | GHSR | Q92847 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3338802 | 0.87 | TSHR (0.50) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL20267540 | 0.77 | TSHR (0.47) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL5555321 | 0.75 | KDM4E (0.51) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL3301730 | 0.74 | TSHR (0.50) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL5560667 | 0.72 | TSHR (0.41) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL95926 | 0.71 | KDM4E (0.56) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL13557891 | 0.71 | KDM4E (0.56) | KDM4EPOLBTSHRCA1ALDH1A1 | |
| SCHEMBL5529079 | 0.71 | KDM4E (0.53) | KDM4EPOLBCTSSTSHRSGMS2 | |
| SCHEMBL2477199 | 0.70 | CTSS (0.45) | KDM4EPOLBCTSSTSHRCTSL | |
| SCHEMBL6043011 | 0.69 | TSHR (0.58) | KDM4EPOLBTSHRCA1ALDH1A1 |
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-2069310-A2 | SULFONYLPYRAZOLINE CARBOXAMIDINE DERIVATIVES AS 5-HT6 ANTAGONISTS | Solvay Pharmaceuticals B.V. (NL) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008034863-A2 | SULFONYLPYRAZOLINE CARBOXAMIDINE DERIVATIVES AS 5-HT6 ANTAGONISTS | SOLVAY PHARMACEUTICALS B.V. (NL) | 2008-03-27 | — | — | WO | disclosed |