⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1048345 | 0.95 | — | — | |
| SCHEMBL1050929 | 0.90 | L3MBTL1 (0.30) | — | |
| SCHEMBL1045173 | 0.86 | TRPA1 (0.33) | — | |
| SCHEMBL1048652 | 0.85 | ALDH1A1 (0.33) | — | |
| SCHEMBL1048140 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL18550415 | 0.79 | ALDH1A1 (0.35) | — | |
| SCHEMBL1045560 | 0.74 | L3MBTL1 (0.36) | — | |
| SCHEMBL15653446 | 0.72 | TAAR1 (0.40) | — | |
| SCHEMBL1049731 | 0.70 | TSHR (0.41) | — | |
| SCHEMBL11427181 | 0.70 | PNMT (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1844337-B1 | BINDING COMPOUNDS, IMMUNOGENIC COMPOUNDS AND PEPTIDOMIMETICS | PEPSCAN SYSTEMS BV (NL) | 2013-07-03 | — | — | EP | disclosed |
| US-7863239-B2 | polypeptide which is cysteine-knot growth factor family member attached to scaffold such as bis(bromomethyl)benzene; point mutations; treating infection and autoimmune disorders | PEPSCAN SYSTEMS B.V. (NL) | 2011-01-04 | — | — | US | disclosed |
| US-20080313749-A1 | Binding Compounds, Immunogenic Compounds and Peptidomimetics | PEPSCAN SYSTEMS B.V. (NL) | 2008-12-18 | — | — | US | disclosed |
| EP-1844337-A1 | BINDING COMPOUNDS, IMMUNOGENIC COMPOUNDS AND PEPTIDOMIMETICS | PEPSCAN SYSTEMS B.V. (NL) | 2007-10-17 | — | — | EP | disclosed |
| WO-2006078161-A1 | BINDING COMPOUNDS, IMMUNOGENIC COMPOUNDS AND PEPTIDOMIMETICS | PEPSCAN SYSTEMS B.V. (NL) | 2006-07-27 | — | — | WO | disclosed |