⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27681417 | 0.91 | USP2 (0.32) | — | |
| SCHEMBL21103130 | 0.86 | ALDH1A1 (0.38) | — | |
| SCHEMBL18102761 | 0.82 | LMNA (0.45) | — | |
| SCHEMBL25869384 | 0.82 | LMNA (0.45) | — | |
| SCHEMBL28181535 | 0.81 | LMNA (0.43) | — | |
| SCHEMBL17303066 | 0.79 | — | — | |
| SCHEMBL14733449 | 0.79 | — | — | |
| SCHEMBL21806635 | 0.78 | — | — | |
| SCHEMBL28043183 | 0.78 | — | — | |
| SCHEMBL27592452 | 0.78 | — | — |
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-9447246-B2 | Method of covalently bonding an organic metal complex to a polymer | CYNORA GMBH (DE) | 2016-09-20 | — | — | US | disclosed |