SCHEMBL719073

SCHEMBL719073

CC1=CCC(C)C(C)C1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
Bicarbonate SCHEMBL10872867 0.89 POLB (0.38)
SCHEMBL12509883 0.77
SCHEMBL16257013 0.77
SCHEMBL22136990 0.77
SCHEMBL6910183 0.77
SCHEMBL10168003 0.77
SCHEMBL13881345 0.77
SCHEMBL35518 0.74
SCHEMBL24180553 0.74
SCHEMBL5864246 0.74

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200325036-A1 HETEROGENEOUS WET SYNTHESIS PROCESS FOR PREPARATION OF HIGH PURITY TUNGSTEN PENTAHALIDE AIR LIQUIDE (FR) 2020-10-15 US disclosed
US-10669160-B2 Heterogeneous wet synthesis process for preparation of high purity tungsten pentahalide L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2020-06-02 US disclosed
US-20190330076-A1 HETEROGENEOUS WET SYNTHESIS PROCESS FOR PREPARATION OF HIGH PURITY TUNGSTEN PENTAHALIDE L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2019-10-31 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
CN-102317247-A Method for producing oxygen-containing compound UNIV UTSUNOMIYA 2012-01-11 CN disclosed
EP-2399897-A1 METHOD FOR PRODUCING OXYGEN-CONTAINING COMPOUND Utsunomiya University (JP) 2011-12-28 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-20040152592-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMTED 2004-08-05 US disclosed
US-6703528-B2 CATALYTIC OXIDATION OF OLEFIN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-09 US disclosed
EP-1188735-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-20 EP disclosed
US-20020025906-A1 Process for producing carbonyl or hydroxy compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-28 US disclosed
US-5698253-A FRESH HERBAL ODOR QUEST INTERNATIONAL B.V. (NL) 1997-12-16 US disclosed
EP-0673408-B1 DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY QUEST INT (NL) 1996-07-24 EP disclosed
EP-0673408-A1 DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY. QUEST INT (NL) 1995-09-27 EP disclosed
WO-1994013766-A2 DIMETHYL-CYCLOHEXANECARBOXYLIC ACID ESTERS IN PERFUMERY QUEST INTERNATIONAL B.V. (NL) 1994-06-23 WO disclosed
US-4861925-A Process for the preparation of nitroolefins W. R. GRACE & CO.-CONN. (US) 1989-08-29 US disclosed
US-4704477-A Trimethylcyclohexene derivatives, their preparation and use as perfume substances CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1987-11-03 US disclosed