⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12875156 | 0.81 | — | — | |
| SCHEMBL12883650 | 0.73 | — | — | |
| SCHEMBL12883648 | 0.73 | — | — | |
| SCHEMBL22626050 | 0.73 | — | — | |
| SCHEMBL21748566 | 0.73 | — | — | |
| SCHEMBL24330040 | 0.73 | — | — | |
| SCHEMBL21748564 | 0.73 | — | — | |
| SCHEMBL12895743 | 0.73 | — | — | |
| SCHEMBL8009629 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL31364061 | 0.71 | NCF1 (0.39) | — |
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-7378525-B2 | CCR8 inhibitors | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2008-05-27 | — | — | US | disclosed |