Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12590856 | 0.83 | HCAR2 (0.41) | NPC1RAB9ACA1CA2CA9 | |
| SCHEMBL12590857 | 0.81 | CA1 (0.39) | NPC1RAB9ACA1CA2CA9 | |
| SCHEMBL31630280 | 0.81 | RAB9A (0.48) | NPC1RAB9ACA1CA2CA9 | |
| SCHEMBL25898246 | 0.81 | CA1 (0.40) | CA1CA2CA9CA12CYP1A2 | |
| SCHEMBL17315250 | 0.80 | IDO1 (0.42) | MAPTKDM4ELMNA | |
| SCHEMBL16133691 | 0.80 | EPHX2 (0.53) | EPHX2NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL2755867 | 0.79 | EPHX2 (0.58) | EPHX2NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL31723871 | 0.78 | TSHR (0.43) | CYP1A2CYP2D6CYP2C19HDAC1HDAC6 | |
| SCHEMBL50403 | 0.78 | EPHX2 (0.57) | EPHX2NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL25308997 | 0.78 | CA1 (0.38) | CA1CA2CA9CA12CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025124698-A1 | ARYL SULFONE AND SULFANONE DERIVATIVES AS OREXIN RECEPTOR MODULATORS | IDORSIA PHARMACEUTICALS LTD (CH) | 2025-06-19 | — | — | WO | disclosed |
| EP-3231798-A1 | THIAZOLE INTERMEDIATES USEFUL IN THE PREPARATION OF RAF KINASE INHIBITORS | Sunesis Pharmaceuticals, Inc. (US) | 2017-10-18 | — | — | EP | disclosed |