⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL295603 | 0.70 | CYP1A2 (0.44) | — | |
| SCHEMBL9355802 | 0.68 | CYP1A2 (0.33) | — | |
| SCHEMBL28686364 | 0.62 | CYP1A2 (0.36) | — | |
| SCHEMBL29614893 | 0.62 | ALDH1A1 (0.36) | — | |
| SCHEMBL6014064 | 0.62 | ALDH1A1 (0.36) | — | |
| SCHEMBL1083352 | 0.60 | GAA (0.31) | — | |
| SCHEMBL23532429 | 0.60 | CYP1A2 (0.35) | — | |
| SCHEMBL8573447 | 0.60 | ALDH1A1 (0.39) | — | |
| SCHEMBL1009054 | 0.60 | ALDH1A1 (0.39) | — | |
| SCHEMBL19020209 | 0.60 | CYP1A2 (0.35) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0273274-B1 | Degradation of polyethylene by means of agents generating free radicals | ATOCHEM ELF DEUTSCHLAND (DE) | 2000-07-12 | — | — | EP | disclosed |
| EP-0444604-A2 | Crosslinking of fluorrubber via crosslinking initiators not forming any methyl- or phenyl-radicals | Elf Atochem Deutschland GmbH (DE) | 1991-09-04 | — | — | EP | disclosed |
| EP-0180789-B1 | CROSS-LINKING OF STYRENE POLYMERS | Luperox GmbH (DE) | 1990-02-28 | — | — | EP | disclosed |
| EP-0073435-B1 | PROCESS FOR CURING AND OPTIONALLY FOAMING POLYPROPYLENE | Luperox GmbH (DE) | 1989-09-20 | — | — | EP | disclosed |
| EP-0180789-A1 | Cross-linking of styrene polymers | Luperox GmbH (DE) | 1986-05-14 | — | — | EP | disclosed |
| EP-0073038-B1 | PROCESS FOR CROSS-LINKING AND IF REQUIRED FOAMING NATURAL OR SYNTHETIC HOMO- AND/OR COPOLYMERS | Luperox GmbH (DE) | 1986-01-02 | — | — | EP | disclosed |
| EP-0073435-A2 | Process for curing and optionally foaming polypropylene | Luperox GmbH (DE) | 1983-03-09 | — | — | EP | disclosed |
| EP-0073038-A1 | Process for cross-linking and if required foaming natural or synthetic homo- and/or copolymers | Luperox GmbH (DE) | 1983-03-02 | — | — | EP | disclosed |