⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10025603 | 0.81 | — | — | |
| SCHEMBL4853891 | 0.76 | PRKCA (0.30) | — | |
| SCHEMBL17853293 | 0.75 | MAOA (0.31) | — | |
| Methoxymethane SCHEMBL28298291 | 0.74 | ITGB2 (0.38) | — | |
| SCHEMBL5730755 | 0.72 | — | — | |
| SCHEMBL10025617 | 0.71 | MAP3K14 (0.31) | — | |
| SCHEMBL456419 | 0.68 | ITGB2 (0.45) | — | |
| SCHEMBL33274 | 0.68 | — | — | |
| SCHEMBL5729433 | 0.68 | MAP3K14 (0.31) | — | |
| SCHEMBL14781421 | 0.67 | LTA4H (0.31) | — |
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-20160181541-A1 | P-doped conjugated small molecular electrolyte and organic electronic devices using the same | GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2016-06-23 | — | — | US | disclosed |