⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL20558814 | 1.00 | — | — | |
| Benzene SCHEMBL483874 | 0.96 | — | — | |
| Benzene SCHEMBL28884397 | 0.96 | — | — | |
| Benzene SCHEMBL28204417 | 0.96 | — | — | |
| Benzene SCHEMBL21828967 | 0.96 | — | — | |
| Benzene SCHEMBL471859 | 0.96 | — | — | |
| Benzene SCHEMBL1899054 | 0.96 | — | — | |
| Propane SCHEMBL10936969 | 0.89 | — | — | |
| Propane SCHEMBL20543508 | 0.89 | — | — | |
| Propane SCHEMBL9410220 | 0.89 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112300409-B | Bionic hydrogel, and preparation method and application thereof | 中国科学院苏州纳米技术与纳米仿生研究所 | 2022-03-04 | — | — | CN | disclosed |
| CN-112300409-A | Bionic hydrogel, and preparation method and application thereof | 中国科学院苏州纳米技术与纳米仿生研究所 | 2021-02-02 | — | — | CN | disclosed |