⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15877978 | 1.00 | — | — | |
| SCHEMBL15879130 | 0.97 | CNR2 (0.39) | — | |
| SCHEMBL28730966 | 0.84 | SOAT1 (0.38) | — | |
| SCHEMBL29284276 | 0.84 | SOAT1 (0.42) | — | |
| SCHEMBL29284243 | 0.82 | SOAT1 (0.44) | — | |
| SCHEMBL29284267 | 0.82 | SOAT1 (0.44) | — | |
| SCHEMBL21996121 | 0.82 | CNR2 (0.45) | — | |
| SCHEMBL148717 | 0.79 | — | — | |
| SCHEMBL148718 | 0.79 | — | — | |
| SCHEMBL26624981 | 0.79 | CNR2 (0.41) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140205688-A1 | STIMULATING AGENT AND STIMULATING COMPOSITION | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2014-07-24 | — | — | US | disclosed |