⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL567044 | 0.79 | — | — | |
| SCHEMBL14955 | 0.79 | — | — | |
| SCHEMBL2198678 | 0.79 | — | — | |
| Alcohol SCHEMBL3948930 | 0.64 | — | — | |
| SCHEMBL17581975 | 0.64 | TSHR (0.46) | — | |
| SCHEMBL1122891 | 0.63 | — | — | |
| SCHEMBL2879507 | 0.62 | — | — | |
| SCHEMBL566845 | 0.62 | — | — | |
| SCHEMBL15073 | 0.62 | — | — | |
| SCHEMBL8082538 | 0.62 | — | — |
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-4981793-A | Biological and chemical method for hydroxylating 4-substituted biphenyls and products obtained therefrom | GENERAL ELECTRIC COMPANY (US) | 1991-01-01 | — | — | US | claimed |