Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 16/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4445219 | 0.79 | TRPM8 (0.44) | SCDCNR2TRPM8 | |
| SCHEMBL4556505 | 0.78 | TRPM8 (0.43) | SCDCYP3A4CYP2D6TRPM8 | |
| SCHEMBL4555897 | 0.71 | CNR2 (0.42) | SCDCNR2TRPM8 | |
| SCHEMBL4557042 | 0.71 | CNR2 (0.39) | CYP2C9CNR2TRPM8 | |
| SCHEMBL4136835 | 0.68 | SCD (0.46) | SCDCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31629219 | 0.67 | SCD (1.00) | SCDCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13930227 | 0.66 | TRPM8 (0.39) | SCDCYP3A4CNR2TRPM8 | |
| SCHEMBL4566242 | 0.66 | CYP3A4 (0.42) | SCDCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13770570 | 0.65 | TRPM8 (0.49) | CYP2D6TRPM8 | |
| SCHEMBL1742505 | 0.65 | CYP2C9 (0.52) | SCDCYP1A2CYP3A4CYP2D6CYP2C9 |
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-2009037542-A2 | SPIROCYCLIC COMPOUNDS AS STEAROYL COA DESATURASE INHIBITORS | GLENMARK PHARMACEUTICALS, S.A. (US) | 2009-03-26 | — | — | WO | disclosed |
| WO-2009037542-A2 | SPIROCYCLIC COMPOUNDS AS STEAROYL COA DESATURASE INHIBITORS | GLENMARK PHARMACEUTICALS, S.A. (US) | 2009-03-26 | — | — | WO | disclosed |