Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 12/20 | 0.82 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.62 |
| ▸ | CACNA1G | O43497 | 7/20 | 0.58 |
| ▸ | CACNA1H | O95180 | 7/20 | 0.58 |
| ▸ | CACNA1I | Q9P0X4 | 7/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2947804 | 1.00 | S1PR1 (0.82) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2947802 | 1.00 | S1PR1 (0.82) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL4687480 | 1.00 | S1PR1 (0.82) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2944012 | 0.94 | S1PR1 (0.84) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2942570 | 0.92 | S1PR1 (0.81) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2944476 | 0.92 | S1PR1 (0.81) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL1383402 | 0.91 | S1PR1 (1.00) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2947553 | 0.90 | S1PR1 (0.88) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2943601 | 0.90 | S1PR1 (0.88) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I | |
| SCHEMBL2940088 | 0.89 | CACNA1G (0.67) | S1PR1S1PR3CACNA1GCACNA1HCACNA1I |
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-1805163-B1 | 1,1A,5,5A-TETRAHYDRO-3-THIA-CYCLOPROPA[A]PENTALENES: TRICYCLIC THIOPHENE DERIVATIVES AS S1P1/EDG1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-10-01 | — | — | EP | claimed |
| EP-1805163-B1 | 1,1A,5,5A-TETRAHYDRO-3-THIA-CYCLOPROPA[A]PENTALENES: TRICYCLIC THIOPHENE DERIVATIVES AS S1P1/EDG1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-10-01 | — | — | EP | disclosed |