⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18107959 | 0.86 | — | — | |
| SCHEMBL5862986 | 0.71 | CYP2C9 (0.32) | — | |
| SCHEMBL5345297 | 0.71 | ALDH1A1 (0.39) | — | |
| SCHEMBL31407008 | 0.70 | — | — | |
| SCHEMBL3362832 | 0.69 | — | — | |
| SCHEMBL17409118 | 0.69 | — | — | |
| SCHEMBL3361823 | 0.69 | — | — | |
| SCHEMBL22949861 | 0.68 | — | — | |
| SCHEMBL20628701 | 0.68 | FUCA1 (0.32) | — | |
| SCHEMBL6737471 | 0.68 | FUCA1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7838609-B2 | Polyvinyl alcohol type resin, monolayer film and laminate | THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-11-23 | — | — | US | disclosed |
| US-20080200633-A1 | Polyvinyl alcohol type resin, monolayer film and laminate | THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) | 2008-08-21 | — | — | US | disclosed |