⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27920548 | 0.80 | SMN1; SMN2 (0.34) | — | |
| Iodide SCHEMBL28054984 | 0.79 | SMN1; SMN2 (0.33) | — | |
| Bromide SCHEMBL27836142 | 0.72 | — | — | |
| SCHEMBL27877158 | 0.69 | — | — | |
| SCHEMBL1706040 | 0.69 | — | — | |
| SCHEMBL27877171 | 0.68 | — | — | |
| SCHEMBL8173104 | 0.65 | — | — | |
| Iodide SCHEMBL28880225 | 0.65 | — | — | |
| SCHEMBL28139194 | 0.65 | — | — | |
| SCHEMBL28139836 | 0.65 | — | — |
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-20230022263-A1 | N-TYPE DOPANTS FOR PHOTOACTIVE REGIONS OF ORGANIC PHOTOVOLTAICS | UNIV KING ABDULLAH SCI & TECH (SA) | 2023-01-26 | — | — | US | disclosed |