⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20757738 | 1.00 | — | — | |
| SCHEMBL26008591 | 1.00 | — | — | |
| SCHEMBL16705637 | 1.00 | — | — | |
| SCHEMBL14922876 | 1.00 | — | — | |
| SCHEMBL14495842 | 1.00 | — | — | |
| SCHEMBL12765188 | 1.00 | — | — | |
| SCHEMBL3040213 | 1.00 | — | — | |
| SCHEMBL12508092 | 1.00 | — | — | |
| SCHEMBL764411 | 0.94 | — | — | |
| SCHEMBL12127048 | 0.94 | — | — |
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-20120077794-A1 | BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS | GLAXSMITHKLINE LLC (US) | 2012-03-29 | — | — | US | disclosed |