⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18405840 | 0.89 | PKM (0.31) | — | |
| SCHEMBL18405839 | 0.87 | PKM (0.35) | — | |
| SCHEMBL18407871 | 0.81 | NOS3 (0.36) | — | |
| SCHEMBL21439938 | 0.77 | — | — | |
| SCHEMBL18748572 | 0.75 | — | — | |
| SCHEMBL21608723 | 0.75 | PKM (0.35) | — | |
| SCHEMBL19309438 | 0.70 | NOS3 (0.30) | — | |
| SCHEMBL12711268 | 0.70 | NOS3 (0.35) | — | |
| SCHEMBL18135050 | 0.69 | PKM (0.38) | — | |
| SCHEMBL18268501 | 0.69 | PKM (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9818946-B2 | Film and organic semiconductor device containing the film | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-11-14 | — | — | US | disclosed |
| US-20170110665-A1 | FILM AND ORGANIC SEMICONDUCTOR DEVICE CONTAINING THE FILM | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-04-20 | — | — | US | disclosed |
| US-20170025613-A1 | COMPOSITION AND POLYMER COMPOUND, AND ORGANIC SEMICONDUCTOR DEVICE COMPRISING THE COMPOSITION OR THE POLYMER COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-01-26 | — | — | US | disclosed |