⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4862267 | 0.88 | ABHD6 (0.33) | — | |
| SCHEMBL14133247 | 0.87 | — | — | |
| SCHEMBL5889441 | 0.84 | — | — | |
| SCHEMBL12966440 | 0.83 | — | — | |
| SCHEMBL14147764 | 0.82 | — | — | |
| SCHEMBL5889436 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL11964319 | 0.78 | CA1 (0.31) | — | |
| SCHEMBL17852542 | 0.77 | — | — | |
| SCHEMBL15999600 | 0.74 | — | — | |
| SCHEMBL25962742 | 0.73 | ABHD6 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9842993-B2 | Film-forming composition, film formed thereby, and method for manufacturing organic semiconductor element using same | CENTRAL GLASS COMPANY, LIMITED (JP) | 2017-12-12 | — | — | US | disclosed |
| WO-2015008720-A1 | FILM-FORMING COMPOSITION, FILM FORMED THEREBY, AND METHOD FOR MANUFACTURING ORGANIC SEMICONDUCTOR ELEMENT USING SAME | セントラル硝子株式会社 (JP) | 2015-01-22 | — | — | WO | disclosed |