Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1853924 | 0.90 | SMN1; SMN2 (0.39) | SMN1; SMN2CYP2D6HTT | |
| SCHEMBL1861942 | 0.84 | SMN1; SMN2 (0.36) | SMN1; SMN2CYP2D6HTT | |
| SCHEMBL1856194 | 0.80 | SMN1; SMN2 (0.35) | SMN1; SMN2CYP2D6HTT | |
| SCHEMBL1857641 | 0.77 | MEN1 (0.33) | SMN1; SMN2CYP2D6HTTSLC6A1 | |
| SCHEMBL688697 | 0.73 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2D6HTTPOLB | |
| SCHEMBL3905171 | 0.73 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2D6HTTPOLB | |
| SCHEMBL688825 | 0.73 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2D6HTTPOLB | |
| SCHEMBL884217 | 0.72 | CYP1A2 (0.42) | SMN1; SMN2SLC6A1 | |
| SCHEMBL4016775 | 0.71 | SMN1; SMN2 (0.32) | SMN1; SMN2CYP2D6HTT | |
| SCHEMBL7261140 | 0.69 | POLB (0.31) | SMN1; SMN2POLBL3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2222667-B1 | NOVEL THIOPHENE DERIVATIVES AS AGONISTS OF S1P1/EDG1 | ACTELION PHARMACEUTICALS LTD (CH) | 2013-02-20 | — | — | EP | claimed |
| EP-2262782-B1 | NOVEL AMINOMETHYL BENZENE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-07-04 | — | — | EP | claimed |
| EP-2262799-B1 | PYRIDINE COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2012-07-04 | — | — | EP | claimed |
| EP-1863475-B1 | NOVEL THIOPHENE DERIVATIVES AS SPHINGOSINE-1-PHOSPHATE-1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-09-07 | — | — | EP | claimed |
| EP-1863787-B1 | HYDOGRENATED BENZO[C]THIOPHENE DERIVATIVES AS IMMUNOMODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-05-25 | — | — | EP | claimed |
| EP-1863474-B1 | NOVEL THIOPHENE DERIVATIVES AS SPHINGOSINE-1-PHOSPHATE-1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-11-12 | — | — | EP | claimed |