⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL720302 | 0.74 | — | — | |
| SCHEMBL19558050 | 0.74 | — | — | |
| SCHEMBL19558060 | 0.74 | — | — | |
| SCHEMBL17886967 | 0.74 | — | — | |
| SCHEMBL7698370 | 0.71 | — | — | |
| SCHEMBL12654600 | 0.70 | — | — | |
| SCHEMBL12654596 | 0.70 | — | — | |
| SCHEMBL710244 | 0.69 | — | — | |
| SCHEMBL18727585 | 0.69 | — | — | |
| SCHEMBL14730420 | 0.65 | MGAM (0.30) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170204330-A1 | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-07-20 | — | — | US | disclosed |
| EP-2399897-B1 | METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND | UNIV UTSUNOMIYA (JP) | 2015-08-12 | — | — | EP | disclosed |
| US-8716501-B2 | Method for producing oxygen-containing compound | UTSUNOMIYA UNIVERSITY (JP) | 2014-05-06 | — | — | US | disclosed |
| US-20120053354-A1 | Method for Producing Oxygen-Containing Compound | UTSUNOMIYA UNIVERSITY (JP) | 2012-03-01 | — | — | US | disclosed |
| EP-2399897-A1 | METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND | Utsunomiya University (JP) | 2011-12-28 | — | — | EP | disclosed |
| EP-2133380-A1 | RESIN COMPOSITION | Sumitomo Chemical Company, Limited (JP) | 2009-12-16 | — | — | EP | disclosed |
| US-20090299111-A1 | (ALKYLPHENYL) ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL) ALKYLCYCLOHEXANE OR ALKYLBIPHENYL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2009-12-03 | — | — | US | disclosed |
| EP-1908743-A1 | (ALKYLPHENYL)ALKYLCYCLOHEXANE AND METHOD FOR PRODUCING (ALKYLPHENYL)ALKYLCYCLOHEXANE OR ALKYLBIPHENYL | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2008-04-09 | — | — | EP | disclosed |
| US-20020025906-A1 | Process for producing carbonyl or hydroxy compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-02-28 | — | — | US | disclosed |
| EP-0199330-B1 | TRIMETHYLCYCLOHEXENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS FRAGRANCES | Consortium für elektrochemische Industrie GmbH (DE) | 1990-12-19 | — | — | EP | disclosed |
| US-4704477-A | Trimethylcyclohexene derivatives, their preparation and use as perfume substances | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1987-11-03 | — | — | US | disclosed |
| EP-0199330-A2 | Trimethylcyclohexene derivatives, their preparation and their use as fragrances | Consortium für elektrochemische Industrie GmbH (DE) | 1986-10-29 | — | — | EP | disclosed |