⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL813728 | 0.92 | — | — | |
| SCHEMBL10382153 | 0.82 | — | — | |
| SCHEMBL11422668 | 0.80 | — | — | |
| SCHEMBL27099538 | 0.78 | — | — | |
| SCHEMBL27493725 | 0.77 | — | — | |
| SCHEMBL2730283 | 0.74 | — | — | |
| SCHEMBL10048190 | 0.73 | — | — | |
| SCHEMBL10875348 | 0.73 | FFAR3 (0.30) | — | |
| SCHEMBL29196448 | 0.73 | — | — | |
| SCHEMBL5167110 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0856532-B1 | Anionic copolymerization of conjugated dienes and vinyl arenes in the presence of alkyl ethers of tetrahydropyranyl methanol | ENICHEM SPA (IT) | 2001-09-26 | — | — | EP | disclosed |
| US-5914378-A | POLYMERIZING: BUTADIENE, ISOPRENE, OR BUTADIENE WITH STYRENE IN AN INERT SOLVENT WITH AN ANIONIC LITHIUM INITIATOR, AND 2-METHOXYMETHYL TETRAHYDROPYRAN AS A MODIFIER; HIGH CONTENT OF VINYL UNITS EVEN AT HIGHER TEMPERATURES | ENICHEM S.P.A. (IT) | 1999-06-22 | — | — | US | disclosed |
| EP-0856532-A1 | Anionic copolymerization of conjugated dienes and vinyl arenes in the presence of alkyl ethers of tetrahydropyranyl methanol | ENICHEM S.p.A. (IT) | 1998-08-05 | — | — | EP | disclosed |