⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL679493 | 0.75 | — | — | |
| SCHEMBL23607775 | 0.73 | — | — | |
| SCHEMBL10382016 | 0.71 | CHRM3 (0.32) | — | |
| SCHEMBL28673874 | 0.68 | ATM (0.40) | — | |
| SCHEMBL4179061 | 0.68 | CHRM2 (0.40) | — | |
| SCHEMBL28673876 | 0.68 | ATM (0.40) | — | |
| SCHEMBL1817163 | 0.68 | MAPK1 (0.36) | — | |
| SCHEMBL2914633 | 0.68 | TFPI2 (0.38) | — | |
| SCHEMBL21747530 | 0.68 | TFPI2 (0.38) | — | |
| SCHEMBL3628876 | 0.67 | CHRM2 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1669405-B1 | VINYL CHLORIDE BASED RESIN COMPOSITION FOR VEHICLE | ADEKA CORP (JP) | 2009-06-10 | — | — | EP | disclosed |
| US-7361704-B2 | Vinyl chloride resin composition for vehicles | ADEKA CORPORATION (JP) | 2008-04-22 | — | — | US | disclosed |
| EP-1669405-A1 | VINYL CHLORIDE BASED RESIN COMPOSITION FOR VEHICLE | Asahi Denka Co., Ltd. (JP) | 2006-06-14 | — | — | EP | disclosed |
| US-20060052517-A1 | Vinyl chloride resin composition for vehicle | ADEKA CORPORATION (JP) | 2006-03-09 | — | — | US | disclosed |