⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6888574 | 0.73 | — | — | |
| SCHEMBL20052961 | 0.71 | — | — | |
| SCHEMBL19337431 | 0.71 | SLC7A5 (0.40) | — | |
| SCHEMBL6889147 | 0.71 | IDO1 (0.30) | — | |
| SCHEMBL14908374 | 0.70 | — | — | |
| SCHEMBL12321824 | 0.70 | — | — | |
| SCHEMBL13287189 | 0.67 | — | — | |
| SCHEMBL17012115 | 0.66 | — | — | |
| SCHEMBL25492952 | 0.65 | — | — | |
| SCHEMBL16068371 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013062605-A1 | NETWORK CONJUGATED POLYMERS WITH ENHANCED SOLUBILITY | HITACHI CHEMICAL RESEARCH, INC. (US) | 2013-05-02 | — | — | WO | disclosed |