Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10415153 | 1.00 | MAOB (0.42) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL5352063 | 0.94 | MAOB (0.41) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL10522046 | 0.94 | MAOB (0.41) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL9222592 | 0.92 | MAOB (0.39) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL16439911 | 0.86 | MAOB (0.46) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL16439910 | 0.86 | MAOB (0.46) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL6862118 | 0.83 | CYP2C19 (0.42) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 | |
| SCHEMBL7174980 | 0.81 | ALDH1A1 (0.43) | MAOBNFE2L2CYP2C19ALDH1A1TSHR | |
| SCHEMBL7868570 | 0.80 | NPC1 (0.40) | NFE2L2CYP2C19ALDH1A1LMNAMAPT | |
| SCHEMBL3854993 | 0.78 | ALDH1A1 (0.48) | MAOBNFE2L2CYP2C19GRM4ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4956123-A | REACTING A STYRENE TYPE COMPOUND WITH A DIHALOACYL PEROXIDE TO MAKE A FLUOROALKYLAROMATIC ESTER | NIPPON OILS & FATS COMPANY, LTD. (JP) | 1990-09-11 | — | — | US | disclosed |
| EP-0189275-B1 | METHOD FOR MANUFACTURE OF FLUORINE-CONTAINING AROMATIC DERIVATIVES | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-10-18 | — | — | EP | disclosed |
| EP-0189275-A2 | Method for manufacture of fluorine-containing aromatic derivatives | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1986-07-30 | — | — | EP | disclosed |