⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8595969 | 0.92 | — | — | |
| SCHEMBL15958585 | 0.92 | — | — | |
| SCHEMBL8580279 | 0.91 | — | — | |
| SCHEMBL8580153 | 0.91 | — | — | |
| SCHEMBL8617110 | 0.91 | — | — | |
| SCHEMBL10080053 | 0.88 | — | — | |
| SCHEMBL9609861 | 0.85 | — | — | |
| SCHEMBL9609817 | 0.85 | — | — | |
| SCHEMBL8582446 | 0.84 | — | — | |
| SCHEMBL6121853 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012066442-A1 | INHIBITORS OF HIV REPLICATION | PFIZER LIMITED (GB) | 2012-05-24 | — | — | WO | disclosed |