⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19721661 | 0.76 | — | — | |
| SCHEMBL20288240 | 0.72 | — | — | |
| SCHEMBL14897781 | 0.69 | — | — | |
| SCHEMBL19721722 | 0.67 | PTGS1 (0.35) | — | |
| SCHEMBL18517077 | 0.67 | ACE2 (0.33) | — | |
| SCHEMBL20288265 | 0.66 | — | — | |
| SCHEMBL19721788 | 0.65 | — | — | |
| SCHEMBL23430057 | 0.64 | CDC25A (0.38) | — | |
| SCHEMBL22414140 | 0.63 | CDC25A (0.36) | — | |
| SCHEMBL16307272 | 0.63 | ACE2 (0.36) | — |
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-20180175299-A1 | ORGANIC THIN FILM TRANSISTOR, METHOD OF MANUFACTURING ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR FILM | FUJIFILM CORPORATION (JP) | 2018-06-21 | — | — | US | disclosed |