⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11214168 | 0.84 | KCNH2 (0.30) | — | |
| SCHEMBL8995131 | 0.84 | KCNH2 (0.30) | — | |
| SCHEMBL29560455 | 0.79 | TSHR (0.42) | — | |
| SCHEMBL9703749 | 0.77 | CYP2D6 (0.33) | — | |
| SCHEMBL3915296 | 0.77 | CYP2D6 (0.33) | — | |
| Bromide SCHEMBL7193811 | 0.74 | GRIK1 (0.34) | — | |
| SCHEMBL1086196 | 0.74 | — | — | |
| SCHEMBL20141752 | 0.74 | — | — | |
| SCHEMBL28244285 | 0.73 | CYP2D6 (0.30) | — | |
| SCHEMBL30045043 | 0.73 | FAAH (0.39) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106188555-B | A kind of tumour intelligently targeting and environment double responsiveness siRNA delivery system and preparation method and application | 中山大学 | 2019-02-05 | — | — | CN | claimed |
| CN-104744628-B | PH-sensitive irregular copolymer as well as preparation method and application thereof | 厦门大学 | 2017-01-18 | — | — | CN | claimed |
| CN-106188555-A | A kind of tumor intelligence targeting and environment double responsiveness siRNA delivery system and preparation method and application | 中山大学 | 2016-12-07 | — | — | CN | claimed |
| CN-106188555-B | A kind of tumour intelligently targeting and environment double responsiveness siRNA delivery system and preparation method and application | 中山大学 | 2019-02-05 | — | — | CN | disclosed |
| CN-106188555-A | A kind of tumor intelligence targeting and environment double responsiveness siRNA delivery system and preparation method and application | 中山大学 | 2016-12-07 | — | — | CN | disclosed |