⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL873125 | 0.71 | — | — | |
| SCHEMBL24324419 | 0.70 | — | — | |
| SCHEMBL20104001 | 0.67 | — | — | |
| SCHEMBL13109566 | 0.67 | — | — | |
| SCHEMBL23283311 | 0.67 | — | — | |
| SCHEMBL6871308 | 0.66 | — | — | |
| SCHEMBL17004015 | 0.66 | — | — | |
| SCHEMBL20635059 | 0.63 | — | — | |
| SCHEMBL12881254 | 0.63 | — | — | |
| SCHEMBL19310592 | 0.60 | — | — |
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-2012115285-A1 | MACROCYCLIC TRIENE LACTONES HAVING UNCONJUGATED TRIENE STRUCTURE, ITS PRODUCTION METHOD AND ITS SYNTHETIC INTERMEDIATE | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2012-08-30 | — | — | WO | disclosed |
| WO-2009120182-A2 | SULFO-POLYMER POWDER AND SULFO-POLYMER POWDER BLENDS WITH CARRIERS AND/OR ACTIVES | EASTMAN CHEMICAL COMPANY (US) | 2009-10-01 | — | — | WO | disclosed |