⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14217368 | 0.87 | — | — | |
| SCHEMBL15785193 | 0.83 | — | — | |
| SCHEMBL19472377 | 0.82 | — | — | |
| SCHEMBL19472358 | 0.81 | — | — | |
| SCHEMBL12979021 | 0.81 | — | — | |
| SCHEMBL19472360 | 0.80 | — | — | |
| SCHEMBL19472354 | 0.80 | — | — | |
| SCHEMBL19718295 | 0.80 | — | — | |
| SCHEMBL26415664 | 0.78 | — | — | |
| SCHEMBL12925133 | 0.78 | — | — |
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-20170237011-A1 | PICENE DERIVATIVE, PHOTOELECTRIC MATERIAL, AND PHOTOELECTRIC DEVICE | ADEKA CORPORATION (JP) | 2017-08-17 | — | — | US | disclosed |