⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17754984 | 1.00 | — | — | |
| SCHEMBL19765267 | 1.00 | — | — | |
| SCHEMBL17754974 | 1.00 | — | — | |
| SCHEMBL17754989 | 1.00 | — | — | |
| SCHEMBL17747413 | 1.00 | — | — | |
| SCHEMBL19765257 | 0.95 | — | — | |
| SCHEMBL19765264 | 0.95 | — | — | |
| SCHEMBL25281488 | 0.93 | — | — | |
| SCHEMBL22400741 | 0.93 | — | — | |
| SCHEMBL28405349 | 0.91 | SMN1; SMN2 (0.30) | — |
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-2017127613-A1 | ORGANIC SEMICONDUCTOR FORMULATION AND APPLICATION THEREOF | THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2017-07-27 | — | — | WO | disclosed |