⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11116699 | 0.71 | — | — | |
| SCHEMBL2516577 | 0.68 | — | — | |
| SCHEMBL5454723 | 0.61 | — | — | |
| SCHEMBL9153986 | 0.60 | — | — | |
| SCHEMBL4400269 | 0.58 | — | — | |
| SCHEMBL8776046 | 0.57 | — | — | |
| SCHEMBL8619996 | 0.54 | — | — | |
| SCHEMBL1028200 | 0.52 | — | — | |
| SCHEMBL1111515 | 0.52 | TSHR (0.40) | — | |
| SCHEMBL7789403 | 0.51 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100323969-A1 | Compounds Binding to P-Selectin | ASTELLAS PHARMA EUROPE B.V. (NL) | 2010-12-23 | — | — | US | disclosed |
| US-20090062186-A1 | Compounds Binding To P-Selectin | YAMANOUCHI ERUOPE B.V. (NL) | 2009-03-05 | — | — | US | disclosed |
| US-20060217294-A1 | Compounds binding to p-selectin | YAMANOUCHI EUROPE B.V. | 2006-09-28 | — | — | US | disclosed |
| EP-1527086-A1 | COMPOUNDS BINDING TO P-SELECTIN | YAMANOUCHI EUROPE B.V. (NL) | 2005-05-04 | — | — | EP | disclosed |
| WO-2004018502-A1 | COMPOUNDS BINDING TO P-SELECTIN | YAMANOUCHI EUROPE B.V. (NL) | 2004-03-04 | — | — | WO | disclosed |