⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15979478 | 0.92 | PTGS1 (0.34) | — | |
| SCHEMBL14725892 | 0.92 | PTGS1 (0.34) | — | |
| SCHEMBL15979475 | 0.84 | KDM4E (0.31) | — | |
| SCHEMBL15979499 | 0.83 | — | — | |
| SCHEMBL16605151 | 0.82 | — | — | |
| SCHEMBL16605150 | 0.82 | — | — | |
| SCHEMBL16605152 | 0.82 | — | — | |
| SCHEMBL16605153 | 0.82 | — | — | |
| SCHEMBL16605138 | 0.82 | — | — | |
| SCHEMBL16605134 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20140243488-A1 | METHOD FOR PRODUCING CONJUGATED POLYMER, CONJUGATED POLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND SOLAR CELL MODULE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2014-08-28 | — | — | US | disclosed |