⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18707481 | 0.86 | — | — | |
| SCHEMBL26372196 | 0.74 | — | — | |
| SCHEMBL21916850 | 0.71 | — | — | |
| SCHEMBL21202099 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL24599687 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL18867878 | 0.68 | — | — | |
| SCHEMBL18541680 | 0.68 | — | — | |
| SCHEMBL23805952 | 0.67 | — | — | |
| SCHEMBL20096963 | 0.67 | KDM4A (0.30) | — | |
| SCHEMBL18576010 | 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 |
|---|---|---|---|---|---|---|---|
| US-20190111016-A1 | METHODS OF TREATING MUSCLE AND LIVER DISORDERS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-04-18 | — | — | US | disclosed |