⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1194013 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL10898245 | 0.72 | — | — | |
| SCHEMBL8522995 | 0.72 | — | — | |
| SCHEMBL28042947 | 0.70 | — | — | |
| SCHEMBL27364445 | 0.67 | — | — | |
| SCHEMBL3939210 | 0.65 | — | — | |
| SCHEMBL1119002 | 0.65 | — | — | |
| SCHEMBL3480964 | 0.65 | — | — | |
| SCHEMBL110898 | 0.63 | — | — | |
| SCHEMBL18467157 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101501210-A | System and compositions for isolating suppressors of HIV-1 protease | SUZHOU SIRNAOMICS BIOPHARMACEU (CN) | 2009-08-05 | — | — | CN | disclosed |