⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8894561 | 1.00 | — | — | |
| SCHEMBL10667390 | 1.00 | — | — | |
| SCHEMBL10667386 | 1.00 | — | — | |
| SCHEMBL11372402 | 1.00 | — | — | |
| SCHEMBL23752415 | 0.92 | SI (0.38) | — | |
| SCHEMBL10836664 | 0.92 | SI (0.38) | — | |
| SCHEMBL9470585 | 0.83 | — | — | |
| SCHEMBL1941147 | 0.67 | — | — | |
| SCHEMBL7007768 | 0.65 | — | — | |
| SCHEMBL8079693 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2008124157-A1 | CARBOCYCLIC COMPOUNDS AND METHODS FOR TREATING EMERGING DISEASES, INCLUDING INFLUENZA AND VENEZUELA EQUINE ENCEPHALITIS VIRUS | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2008-10-16 | — | — | WO | disclosed |