⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16519679 | 0.90 | — | — | |
| SCHEMBL17970616 | 0.87 | — | — | |
| SCHEMBL94083 | 0.86 | ESR1 (0.31) | — | |
| SCHEMBL94175 | 0.82 | ESR1 (0.33) | — | |
| SCHEMBL20493844 | 0.80 | ESR1 (0.32) | — | |
| SCHEMBL15722867 | 0.78 | ESR1 (0.31) | — | |
| SCHEMBL94043 | 0.77 | ESR1 (0.32) | — | |
| SCHEMBL18416013 | 0.77 | — | — | |
| SCHEMBL3438614 | 0.77 | ESR1 (0.32) | — | |
| SCHEMBL5701660 | 0.76 | POLB (0.33) | — |
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-9520576-B2 | Gas barrier film and electronic apparatus | Konica Minolta, Inc. (JP) | 2016-12-13 | — | — | US | disclosed |
| US-20140322478-A1 | GAS BARRIER FILM AND ELECTRONIC APPARATUS | Konica Minolta, Inc. (JP) | 2014-10-30 | — | — | US | disclosed |