⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17562231 | 0.91 | TUBB4A (0.33) | — | |
| SCHEMBL17562222 | 0.90 | TUBB4A (0.31) | — | |
| SCHEMBL17562190 | 0.90 | TUBB4A (0.32) | — | |
| SCHEMBL15790437 | 0.88 | PGR (0.33) | — | |
| SCHEMBL17998072 | 0.87 | — | — | |
| SCHEMBL19653759 | 0.87 | TUBB4A (0.32) | — | |
| SCHEMBL15790353 | 0.87 | PGR (0.33) | — | |
| SCHEMBL19653758 | 0.87 | TUBB4A (0.32) | — | |
| SCHEMBL12306591 | 0.87 | TUBB4A (0.35) | — | |
| SCHEMBL15480233 | 0.87 | TUBB4A (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016126035-A1 | ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE COMPRISING SAME | 덕산네오룩스 주식회사 | 2016-08-11 | — | — | WO | disclosed |