⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10032089 | 0.74 | — | — | |
| SCHEMBL10032096 | 0.73 | DGAT1 (0.35) | — | |
| SCHEMBL11071801 | 0.65 | DGAT1 (0.43) | — | |
| SCHEMBL9906814 | 0.62 | DGAT1 (0.32) | — | |
| SCHEMBL6774761 | 0.61 | DGAT1 (0.43) | — | |
| SCHEMBL22105961 | 0.60 | DGAT1 (0.41) | — | |
| SCHEMBL18467265 | 0.57 | ELANE (0.46) | — | |
| SCHEMBL22962550 | 0.57 | DGAT1 (0.46) | — | |
| SCHEMBL47394 | 0.57 | DGAT1 (0.46) | — | |
| SCHEMBL18860423 | 0.56 | DGAT1 (0.41) | — |
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-8124693-B2 | Polyisobutylene-based block anionomers and cationomers and synthesis thereof | THE UNIVERSITY OF AKRON (US) | 2012-02-28 | — | — | US | disclosed |