⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL29855981 | 0.81 | CA12 (0.31) | — | |
| SCHEMBL29442074 | 0.79 | — | — | |
| SCHEMBL7599516 | 0.79 | — | — | |
| SCHEMBL31614548 | 0.78 | ACHE (0.33) | — | |
| SCHEMBL6911968 | 0.78 | ACHE (0.33) | — | |
| SCHEMBL30310732 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL126922 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL116944 | 0.76 | — | — | |
| SCHEMBL31259480 | 0.75 | — | — | |
| SCHEMBL31259483 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110098434-A1 | ISOPRENE-BASED POLYMER CYCLIZED PRODUCT, ALICYCLIC POLYMER, AND OPTICAL RESIN | ZEON CORPORATION (JP) | 2011-04-28 | — | — | US | disclosed |
| US-7868107-B2 | Process for producing cycloolefin addition polymer, catalyst for addition polymerization of cycloolefin, and transition metal compound | ZEON CORPORATION (JP) | 2011-01-11 | — | — | US | disclosed |
| US-20090124769-A1 | e.g. copolymerization of dicyclopentadiene with ethylene in presence of (t-butylamide)dimethyl-9-[octamethyloctahydrobenzofluorenyl]silanetitanium dimethyl(tetrahydrofuran) complex catalyst; exhibits high activity for both of addition homopolymerization of a cycloolefin and copolymerization with olefin | ZEON CORPORATION (JP) | 2009-05-14 | — | — | US | disclosed |