Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD2 | O60906 | 2/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PLK1 | P53350 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.33 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.33 |
| ▸ | CHAT | P28329 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL27456879 | 0.76 | GRIK1 (0.37) | SMPD2PTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL27470884 | 0.75 | HTR6 (0.43) | SMPD2PTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL7138338 | 0.73 | HTR6 (0.48) | — | |
| SCHEMBL27508534 | 0.70 | ALDH1A1 (0.33) | MEN1ALDH1A1KMT2A | |
| SCHEMBL27862055 | 0.68 | RXRA (0.46) | SMPD2PTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL27951757 | 0.65 | PTGS1 (0.59) | PTGS1PTGS2HDAC8HDAC6RXRA | |
| SCHEMBL6385852 | 0.64 | RXRA (0.47) | SMPD2PTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL30373858 | 0.63 | SMPD2 (0.49) | SMPD2PTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL3317966 | 0.63 | RXRA (0.53) | SMPD2HDAC8HDAC6MTNR1AMTNR1B | |
| SCHEMBL615456 | 0.63 | SMPD2 (0.51) | SMPD2PTGS1PTGS2HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1148356-C | Benzosulfone derivatives | - | 2004-05-05 | — | — | CN | disclosed |
| CN-1231287-A | Benzosulfone derivatives | HOFFMANN LA ROCHE (CH) | 1999-10-13 | — | — | CN | disclosed |