⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15289894 | 1.00 | — | — | |
| SCHEMBL583681 | 0.80 | — | — | |
| SCHEMBL14959370 | 0.74 | MEN1 (0.32) | — | |
| SCHEMBL19073812 | 0.74 | MEN1 (0.32) | — | |
| SCHEMBL15034 | 0.74 | CA1 (0.41) | — | |
| SCHEMBL2860232 | 0.74 | CA1 (0.41) | — | |
| SCHEMBL8104271 | 0.74 | CA1 (0.41) | — | |
| SCHEMBL15195848 | 0.74 | CA1 (0.41) | — | |
| SCHEMBL439067 | 0.74 | CA1 (0.41) | — | |
| SCHEMBL732959 | 0.74 | CA1 (0.41) | — |
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-2017060418-A1 | PROTECTED CARBOXYLIC ACID-BASED METABOLITES FOR THE TREATMENT OF MITOCHONDRIA-RELATED DISEASES | NEUROVIVE PHARMACEUTICAL AB (SE) | 2017-04-13 | — | — | WO | disclosed |