Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARD | Q03181 | 2/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SAT1 | P21673 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14986338 | 0.88 | PPARD (0.61) | PPARDTSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL6030230 | 0.85 | PPARD (0.76) | PPARDTSHRCA12CA1CA2 | |
| SCHEMBL14983985 | 0.81 | PPARD (0.53) | PPARDTSHRCA12CA1CA2 | |
| SCHEMBL14986339 | 0.80 | PPARD (0.57) | PPARDTSHRS1PR2S1PR4S1PR1 | |
| SCHEMBL3978120 | 0.80 | — | — | |
| SCHEMBL14948795 | 0.80 | PPARD (0.52) | PPARDCA12CA1CA2CA9 | |
| SCHEMBL11436912 | 0.79 | PPARD (0.55) | PPARDTSHRSAT1S1PR2S1PR4 | |
| SCHEMBL7937648 | 0.78 | PPARD (0.67) | PPARDTSHRTP53TDP1CETP | |
| SCHEMBL1305614 | 0.78 | — | — | |
| SCHEMBL491800 | 0.78 | PPARD (0.62) | PPARDTSHRSAT1S1PR2S1PR4 |
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-2012035303-A2 | A NOVEL PROCESS FOR SYNTHESIS OF RAMELTEON, AND KEY INTERMEDIATES FOR THE SYNTHESIS OF RAMELTEON | CIPLA LIMITED ET AL (IN) | 2012-03-22 | — | — | WO | disclosed |