⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6746530 | 0.98 | — | — | |
| SCHEMBL8582475 | 0.95 | — | — | |
| SCHEMBL13556416 | 0.93 | — | — | |
| SCHEMBL17097408 | 0.91 | GSTK1 (0.30) | — | |
| SCHEMBL7032167 | 0.91 | — | — | |
| SCHEMBL27372565 | 0.88 | NAAA (0.32) | — | |
| SCHEMBL5855479 | 0.85 | — | — | |
| SCHEMBL15255415 | 0.85 | — | — | |
| SCHEMBL3214683 | 0.85 | ALDH1A1 (0.34) | — | |
| SCHEMBL26839 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019078585-A1 | NON-REACTIVE FLUORINE-BASED COMPOUND AND PHOTOPOLYMERIZABLE COMPOSITION INCLUDING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |
| US-6727316-B1 | FREE-RADICAL ADDITION COPOLYMERIZATION OF UNSATURATED MONOMERS | BASF COATINGS AG (DE) | 2004-04-27 | — | — | US | disclosed |