⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11745142 | 0.86 | — | — | |
| SCHEMBL11746029 | 0.85 | — | — | |
| SCHEMBL17662626 | 0.81 | — | — | |
| SCHEMBL28041304 | 0.76 | — | — | |
| SCHEMBL11748738 | 0.75 | — | — | |
| SCHEMBL4623618 | 0.75 | — | — | |
| SCHEMBL27289308 | 0.74 | — | — | |
| SCHEMBL18822628 | 0.74 | — | — | |
| SCHEMBL14161609 | 0.74 | — | — | |
| SCHEMBL11746810 | 0.73 | CA1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102844115-B | Alkylated reaction catalyst and employ the manufacture method of alkyl aromatic hydrocarbon compound of this catalyst | UBE INDUSTRIES, LTD. (JP) | 2015-12-09 | — | — | CN | disclosed |
| US-8772529-B2 | Catalyst for alkylation and process for producing alkylaromatic hydrocarbon compound using the catalyst | UBE INDUSTRIES, LTD (JP) | 2014-07-08 | — | — | US | disclosed |
| EP-2581133-A1 | CATALYST FOR ALKYLATION AND PROCESS FOR PRODUCING ALKYLAROMATIC HYDROCARBON COMPOUND USING THE CATALYST | Ube Industries, Ltd. (JP) | 2013-04-17 | — | — | EP | disclosed |
| US-20130041174-A1 | CATALYST FOR ALKYLATION AND PROCESS FOR PRODUCING ALKYLAROMATIC HYDROCARBON COMPOUND USING THE CATALYST | UBE INDUESTRIES, LTD. (JP) | 2013-02-14 | — | — | US | disclosed |
| US-4005152-A | Cycloalkenynes and a method for the preparation thereof | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1977-01-25 | — | — | US | disclosed |