Ethylbenzene

Ethylbenzene

SCHEMBL2090159

CCc1ccccc1.Cc1ccc(C)cc1.Cc1cccc(C)c1.Cc1ccccc1C

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
ACHE P22303 4/20 0.46
LMNA P02545 3/20 0.42
TSHR P16473 3/20 0.42
ALOX12 P18054 1/20 0.42
CYP2C19 P33261 5/20 0.42
CYP1A2 P05177 3/20 0.42
TAAR1 Q96RJ0 1/20 0.41
RAPGEF4 Q8WZA2 1/20 0.41
KDM4E B2RXH2 2/20 0.41
IDO1 P14902 2/20 0.40
HTT P42858 1/20 0.40
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 2/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.39
BCHE P06276 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Ethylbenzene SCHEMBL17318272 1.00 TP53 (0.54) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL27366576 1.00 TP53 (0.54) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL28743490 1.00 TP53 (0.54) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL11134930 0.94 TP53 (0.61) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL27772112 0.92 TP53 (0.64) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL891495 0.90 TP53 (0.67) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL1265120 0.90 TP53 (0.67) TP53ACHELMNATSHRALOX12
Ethylbenzene SCHEMBL8998747 0.90 TP53 (0.67) TP53ACHELMNATSHRALOX12
Isopropylbenzene SCHEMBL28175652 0.89 TP53 (0.42) TP53ACHELMNACYP2C19CYP1A2
Phenylacetylene SCHEMBL28768363 0.87 TP53 (0.41) TP53ACHELMNATSHRCYP2C19

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
CN-112679304-B Method for producing p-xylene 中国石油化工股份有限公司 2022-11-04 CN disclosed
CN-112679305-B Method for producing p-xylene 中国石油化工股份有限公司 2022-10-11 CN disclosed
CN-112679304-A Method for producing p-xylene 中国石油化工股份有限公司 2021-04-20 CN disclosed
CN-112679305-A Method for producing p-xylene 中国石油化工股份有限公司 2021-04-20 CN disclosed
EP-1867372-B1 METHOD FOR CRYSTALLIZATION OF PARAXYLENE THROUGH ADIABATIC COOLING TSUKISHIMA KIKAI CO (JP) 2012-10-10 EP disclosed
EP-1867373-B1 METHOD FOR CRYSTALLIZATION OF PARAXYLENE THROUGH ADIABATIC COOLING TSUKISHIMA KIKAI CO (JP) 2012-08-22 EP disclosed
US-8163970-B2 Method for adiabatic cooling type crystallization of organic compound and apparatus therefor TSUKISHIMA KIKAI CO., LTD. (JP) 2012-04-24 US disclosed
US-7900473-B2 Method for adiabatic cooling type crystallization of organic compound and apparatus therefor TSUKISHIMA KIKAI CO., LTD. (JP) 2011-03-08 US disclosed
CN-101151079-B Method and apparatus for the adiabatic cooled crystallization of organic compounds TSUKISHIMA KIKAI CO 2010-09-22 CN disclosed
US-20100192625-A1 Method for Adiabatic Cooling Type Crystallization of Organic Compound and Apparatus Therefor TSUKISHIMA KIKAI CO., LTD. 2010-08-05 US disclosed
EP-1867373-A1 METHOD AND APPARATUS FOR CRYSTALLIZATION OF ORGANIC COMPOUND THROUGH ADIABATIC COOLING Tsukishima Kikai Co., Ltd. (JP) 2007-12-19 EP disclosed
US-7067052-B2 Process for the production of reformate having reduced ethylbenzene content EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-27 US disclosed
US-20050167338-A1 Para-xylene process using perm-selective separations BP CORPORATION NORTH AMERICA INC. 2005-08-04 US disclosed
US-20050171395-A1 Xylene process using perm-selective separations BP CORPORATION NORTH AMERICA INC. 2005-08-04 US disclosed
US-20050000859-A1 Process for the production of reformate having reduced ethylbenzene content EXXONMOBIL CHEMICAL PATENTS INC. 2005-01-06 US disclosed
US-5654489-A Process for producing alicyclic diketone compounds NEW JAPAN CHEMICAL CO., LTD. (JP) 1997-08-05 US disclosed
EP-0729446-A1 PRODUCTION OF PARA-XYLENE BY SELECTIVE METHYLATION OF TOLUENE WITH METHYL HALIDES Gaz Métropolitain and Company, Limited Partnership (CA) 1996-09-04 EP disclosed
EP-0697389-A1 Process for producing alicyclic diketone compounds NEW JAPAN CHEMICAL CO.,LTD. (JP) 1996-02-21 EP disclosed
WO-1995013998-A1 PRODUCTION OF PARA-XYLENE BY SELECTIVE METHYLATION OF TOLUENE WITH METHYL HALIDES GAZ METROPOLITAIN AND COMPANY, LIMITED PARTNERSHIP (CA) 1995-05-26 WO disclosed
US-5324702-A Catalytic oxidation and oxidative dehydrogenation using metal-compound-loaded, deboronated hams-1b crystalline borosilicate molecular sieve compositions AMOCO CORPORATION (US) 1994-06-28 US disclosed