Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | FDPS | P14324 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.58 |
| ▸ | MAPT | P10636 | 11/20 | 0.58 |
| ▸ | HPGD | P15428 | 7/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | TTR | P02766 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675123 | 0.83 | FDPS (0.66) | CYP2C9NPSR1FDPSALDH1A1MAPT | |
| SCHEMBL9442186 | 0.80 | FDPS (0.90) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL17833422 | 0.80 | FDPS (0.68) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL462735 | 0.79 | FDPS (0.45) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL458398 | 0.79 | HTT (0.49) | HTT | |
| SCHEMBL9442183 | 0.78 | FDPS (0.87) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL8719147 | 0.78 | FDPS (0.87) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL5973815 | 0.78 | FDPS (1.00) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL17831073 | 0.78 | FDPS (0.70) | CYP2C9NPSR1NPC1RAB9AFDPS | |
| SCHEMBL28041128 | 0.78 | FDPS (0.79) | CYP2C9NPSR1NPC1RAB9AFDPS |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012032532-A1 | \"PROCESSES FOR THE PREPARATION OF 4'-[3-[4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PIPERIDINO]PROPOXY]-3'-METHOXYACETOPHENONE AND INTERMEDIATES THEREOF\ | SYMED LABS LIMITED (IN) | 2012-03-15 | — | — | WO | disclosed |