⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13019133 | 0.78 | — | — | |
| SCHEMBL14117404 | 0.78 | — | — | |
| SCHEMBL12249985 | 0.78 | — | — | |
| SCHEMBL13184105 | 0.78 | — | — | |
| SCHEMBL12368601 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL25712091 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL24709409 | 0.76 | — | — | |
| SCHEMBL12133637 | 0.76 | — | — | |
| SCHEMBL12680074 | 0.76 | — | — | |
| SCHEMBL5433577 | 0.76 | — | — |
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-20100222546-A1 | METHODS FOR THE PREPARATION OF FUNCTIONALIZED PEPTIDES, PROTEINS AND CARBOHYDRATES AND THEIR CONJUGATES | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2010-09-02 | — | — | US | disclosed |