⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2011304 | 0.79 | — | — | |
| SCHEMBL9046563 | 0.78 | — | — | |
| SCHEMBL11117982 | 0.75 | — | — | |
| SCHEMBL6140059 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL446887 | 0.67 | — | — | |
| SCHEMBL5446574 | 0.67 | — | — | |
| SCHEMBL11778317 | 0.63 | — | — | |
| SCHEMBL787874 | 0.58 | — | — | |
| SCHEMBL18423816 | 0.58 | — | — | |
| SCHEMBL2337681 | 0.56 | — | — |
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-1991005754-A2 | DERIVATIVES OF LONG-CHAIN FATTY ALCOHOLS AND THEIR APPLICATIONS, IN PARTICULAR AS CYTOTROPHIC AND CYTOPROTECTIVE MOLECULES, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | MEDAFOR (FR) | 1991-05-02 | — | — | WO | disclosed |