⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26976460 | 0.91 | ALDH1A1 (0.32) | — | |
| SCHEMBL18664489 | 0.88 | — | — | |
| SCHEMBL19432233 | 0.88 | — | — | |
| SCHEMBL18638491 | 0.88 | — | — | |
| SCHEMBL20007762 | 0.86 | — | — | |
| SCHEMBL23516124 | 0.79 | — | — | |
| SCHEMBL1191595 | 0.78 | LMNA (0.41) | — | |
| SCHEMBL24621607 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL16021855 | 0.77 | — | — | |
| SCHEMBL24310406 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11860536-B2 | Three-dimensional crosslinker composition and method of manufacturing electronic devices using the same | UNIST (ULSAN NATIONAL INSTITUTE OF SCIENCE AND TECHNOLOGY) (KR) | 2024-01-02 | — | — | US | disclosed |