⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL598089 | 0.74 | — | — | |
| SCHEMBL12369611 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL1140792 | 0.67 | — | — | |
| SCHEMBL337832 | 0.67 | — | — | |
| SCHEMBL20180370 | 0.67 | — | — | |
| SCHEMBL18052192 | 0.67 | — | — | |
| SCHEMBL9274401 | 0.67 | — | — | |
| SCHEMBL4666901 | 0.67 | — | — | |
| SCHEMBL8618313 | 0.65 | CNR2 (0.50) | — | |
| SCHEMBL12386550 | 0.65 | LMNA (0.39) | — |
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-2016086103-A1 | FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY | CATABASIS PHARMACEUTICALS, INC. (US) | 2016-06-02 | — | — | WO | disclosed |