⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27954089 | 0.77 | — | — | |
| SCHEMBL26287 | 0.75 | — | — | |
| SCHEMBL727693 | 0.69 | — | — | |
| SCHEMBL26092 | 0.67 | — | — | |
| SCHEMBL15404001 | 0.67 | — | — | |
| SCHEMBL144306 | 0.67 | — | — | |
| SCHEMBL3234382 | 0.67 | — | — | |
| SCHEMBL9706560 | 0.67 | — | — | |
| SCHEMBL15402839 | 0.65 | — | — | |
| SCHEMBL15403489 | 0.65 | — | — |
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-1992010454-A1 | PARTIALLY FLUORINATED ALKANOLS HAVING A TERTIARY STRUCTURE | ALLIED-SIGNAL INC. (US) | 1992-06-25 | — | — | WO | claimed |