Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 5/20 | 0.48 |
| ▸ | IKBKB | O14920 | 3/20 | 0.46 |
| ▸ | GLS | O94925 | 8/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CHUK | O15111 | 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 | |
|---|---|---|---|---|
| SCHEMBL4100789 | 0.89 | SCD (0.60) | SCDIKBKBGLS | |
| SCHEMBL27765327 | 0.81 | SCD (0.60) | SCD | |
| SCHEMBL4087727 | 0.81 | SCD (0.41) | SCDIKBKBGLSCHUK | |
| SCHEMBL4094392 | 0.79 | SCD (0.60) | SCDIKBKBGLS | |
| SCHEMBL4094873 | 0.73 | SCD (0.53) | SCDGLSTP53 | |
| SCHEMBL4086869 | 0.73 | SCD (0.48) | SCDIKBKB | |
| SCHEMBL4097100 | 0.73 | SCD (0.50) | SCDIKBKBGLS | |
| SCHEMBL22051458 | 0.71 | IKBKB (0.50) | IKBKBCHUK | |
| SCHEMBL4094322 | 0.70 | SCD (0.54) | SCD | |
| SCHEMBL4267662 | 0.69 | IKBKB (0.40) | SCDIKBKB |
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-1902051-A1 | AZACYCLOHEXANE DERIVATIVES AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE | Merck Frosst Canada Ltd. (CA) | 2008-03-26 | — | — | EP | disclosed |
| WO-2006130986-A1 | AZACYCLOHEXANE DERIVATIVES AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE | MERCK FROSST CANADA LTD. (CA) | 2006-12-14 | — | — | WO | disclosed |