⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3690446 | 0.80 | PROKR1 (0.36) | — | |
| SCHEMBL3689624 | 0.80 | RBP4 (0.39) | — | |
| SCHEMBL3689868 | 0.79 | MARK3 (0.34) | — | |
| SCHEMBL3684563 | 0.79 | P2RX7 (0.34) | — | |
| SCHEMBL3691038 | 0.79 | PTK6 (0.35) | — | |
| SCHEMBL3693336 | 0.78 | RBP4 (0.38) | — | |
| SCHEMBL3688803 | 0.77 | RBP4 (0.40) | — | |
| SCHEMBL3688355 | 0.77 | MARK3 (0.36) | — | |
| SCHEMBL3788870 | 0.77 | PTK6 (0.35) | — | |
| SCHEMBL3688368 | 0.77 | LCK (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100204265-A1 | Certain Nitrogen Containing Bicyclic Chemical Entities for Treating Viral Infections | GENELABS TECHNOLOGIES, INC. | 2010-08-12 | — | — | US | disclosed |