⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24221266 | 0.75 | — | — | |
| SCHEMBL17366427 | 0.74 | — | — | |
| SCHEMBL18675345 | 0.71 | — | — | |
| SCHEMBL11996153 | 0.66 | — | — | |
| SCHEMBL14181440 | 0.66 | — | — | |
| SCHEMBL7050896 | 0.66 | LMNA (0.32) | — | |
| SCHEMBL6763644 | 0.66 | LMNA (0.32) | — | |
| SCHEMBL6766121 | 0.66 | LMNA (0.32) | — | |
| SCHEMBL17366434 | 0.65 | — | — | |
| SCHEMBL1640968 | 0.64 | — | — |
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-20130061752-A1 | Tetratopic Phenyl Compounds, Related Metal-Organic Framework Materials and Post-Assembly Elaboration | NORTHWESTERN UNIVERSITY (US) | 2013-03-14 | — | — | US | disclosed |