⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2474802 | 0.81 | TAAR1 (0.57) | — | |
| SCHEMBL5480250 | 0.78 | — | — | |
| SCHEMBL10211017 | 0.77 | — | — | |
| SCHEMBL369710 | 0.77 | TAAR1 (0.53) | — | |
| SCHEMBL6343508 | 0.77 | — | — | |
| SCHEMBL46657 | 0.77 | — | — | |
| SCHEMBL21386193 | 0.77 | — | — | |
| SCHEMBL5355358 | 0.76 | TAAR1 (0.52) | — | |
| SCHEMBL1971764 | 0.75 | TAAR1 (0.47) | — | |
| SCHEMBL8233905 | 0.74 | TAAR1 (0.55) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100409840-C | Methods for increasing bone formation using inhibitors of glycogen synthase kinase-3 betta | HOFFMANN LA ROCHE (CH) | 2008-08-13 | — | — | CN | claimed |
| US-20040039040-A1 | Urea derivative and adhesive-molecule inhibitor containing the same as active ingredient | TORAY INDUSTRIES, INC. (JP) | 2004-02-26 | — | — | US | disclosed |
| EP-1323709-A1 | UREA DERIVATIVE AND ADHESIVE-MOLECULE INHIBITOR CONTAINING THE SAME AS ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2003-07-02 | — | — | EP | disclosed |