Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 20/20 | 0.88 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.50 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2416941 | 0.97 | S1PR1 (0.82) | S1PR1S1PR3S1PR5 | |
| SCHEMBL2417428 | 0.94 | S1PR1 (1.00) | S1PR1S1PR3S1PR5 | |
| SCHEMBL3467816 | 0.90 | S1PR1 (0.82) | S1PR1S1PR3 | |
| SCHEMBL2485876 | 0.89 | S1PR1 (0.88) | S1PR1S1PR3S1PR5 | |
| SCHEMBL4746452 | 0.88 | S1PR1 (0.67) | S1PR1S1PR3 | |
| SCHEMBL2413715 | 0.86 | S1PR1 (1.00) | S1PR1S1PR3 | |
| SCHEMBL2168613 | 0.85 | S1PR1 (0.84) | S1PR1S1PR3S1PR5 | |
| SCHEMBL2420128 | 0.85 | S1PR1 (0.83) | S1PR1S1PR3S1PR5 | |
| SCHEMBL16659664 | 0.83 | S1PR1 (0.90) | S1PR1S1PR3 | |
| SCHEMBL2181741 | 0.82 | S1PR1 (0.79) | S1PR1S1PR3S1PR5 |
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-2376484-A1 | OXADIAZOLE FUSED HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF MULTIPLE SCLEROSIS | Merck Serono S.A. (CH) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010069949-A1 | OXADIAZOLE FUSED HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF MULTIPLE SCLEROSIS | MERCK SERONO S.A. (CH) | 2010-06-24 | — | — | WO | disclosed |