⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL5115726 | 0.79 | ALDH1A1 (0.63) | — | |
| SCHEMBL2061624 | 0.77 | ALDH1A1 (0.35) | — | |
| SCHEMBL486434 | 0.73 | — | — | |
| SCHEMBL15544263 | 0.73 | — | — | |
| SCHEMBL25043395 | 0.73 | — | — | |
| SCHEMBL3891189 | 0.73 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL2062301 | 0.73 | KMT2A (0.40) | — | |
| SCHEMBL464450 | 0.71 | — | — | |
| SCHEMBL20518770 | 0.71 | — | — | |
| SCHEMBL3158473 | 0.71 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1988081-B1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO LTD (JP) | 2012-10-17 | — | — | EP | disclosed |
| EP-1988081-B1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO LTD (JP) | 2012-10-17 | — | — | EP | disclosed |
| CN-101415687-B | Binding inhibitor of sphingosine-1-phosphate | TAISHO PHARMACEUTICAL CO.,LTD. (JP) | 2012-02-08 | — | — | CN | disclosed |
| US-7994204-B2 | Binding inhibitor of sphingosine-1-phosphate | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2011-08-09 | — | — | US | disclosed |
| US-7994204-B2 | Binding inhibitor of sphingosine-1-phosphate | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2011-08-09 | — | — | US | disclosed |
| US-7994204-B2 | Binding inhibitor of sphingosine-1-phosphate | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2011-08-09 | — | — | US | disclosed |
| US-20090182144-A1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2009-07-16 | — | — | US | disclosed |
| US-20090182144-A1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2009-07-16 | — | — | US | disclosed |
| US-20090182144-A1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2009-07-16 | — | — | US | disclosed |
| CN-101415687-A | Binding inhibitor of sphingosine-1-phosphate | TAISHO PHARMACEUTICAL CO LTD (JP) | 2009-04-22 | — | — | CN | disclosed |
| EP-1988081-A1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2008-11-05 | — | — | EP | disclosed |
| EP-1988081-A1 | BINDING INHIBITOR OF SPHINGOSINE-1-PHOSPHATE | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2008-11-05 | — | — | EP | disclosed |