⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2713322 | 0.88 | MEN1 (0.33) | — | |
| SCHEMBL15200760 | 0.88 | MEN1 (0.33) | — | |
| SCHEMBL12168498 | 0.88 | MEN1 (0.33) | — | |
| SCHEMBL28400522 | 0.86 | — | — | |
| SCHEMBL22400743 | 0.83 | — | — | |
| SCHEMBL20082353 | 0.83 | — | — | |
| SCHEMBL12098779 | 0.83 | — | — | |
| SCHEMBL28404084 | 0.82 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL2727413 | 0.81 | — | — | |
| SCHEMBL18665472 | 0.81 | MEN1 (0.32) | — |
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-111763306-A | Method for regulating and controlling short-wave near-infrared fluorescence of D-A type conjugated polymer | 青岛理工大学 | 2020-10-13 | — | — | CN | disclosed |
| CN-103265687-A | Polymer material containing large-volume branching alkoxy side chain, as well as preparation method and application of polymer material | UNIV JILIN | 2013-08-28 | — | — | CN | disclosed |