⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1044747 | 0.97 | — | — | |
| SCHEMBL344476 | 0.79 | — | — | |
| SCHEMBL27905686 | 0.75 | — | — | |
| SCHEMBL1042894 | 0.69 | — | — | |
| SCHEMBL27574206 | 0.69 | — | — | |
| SCHEMBL18229252 | 0.67 | HTR1A (0.36) | — | |
| SCHEMBL11743331 | 0.67 | — | — | |
| SCHEMBL10913606 | 0.65 | — | — | |
| SCHEMBL4653084 | 0.65 | — | — | |
| SCHEMBL8173001 | 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 |
|---|---|---|---|---|---|---|---|
| CN-108463493-A | The polymer substrate on the surface with the biomolecule adherency for possessing reduction and the thermoplastic article of this substrate | SIO2医药产品公司 | 2018-08-28 | — | — | CN | disclosed |