Ethylbenzene

Ethylbenzene

SCHEMBL3682234

C1=CSCS1.CCc1ccccc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.64
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
SLC6A2 P23975 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
CALM1 P0DP23 1/20 0.36
KDM1A O60341 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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 SCHEMBL2308215 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL27454352 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL1331299 0.80
Ethylbenzene SCHEMBL1332452 0.80
Ethylbenzene SCHEMBL1330604 0.80
Ethylbenzene SCHEMBL3987542 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL27395806 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL7458207 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL11223212 0.80 TP53 (1.00) TP53RAB9AKDM4ETAAR1CALM1
Ethylbenzene SCHEMBL29 0.80

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0334051-B1 Electron beam-curable composition for release material and process for preparation of release material SHOWA DENKO KK (JP) 1996-05-01 EP claimed
EP-2155808-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING Essilor International (Compagnie Générale D'Optique) (FR) 2010-02-24 EP disclosed
WO-2009121148-A1 DYE COMPRISING FUNCTIONAL SUBSTITUENT ADVANCED POLYMERIK PTY LTD (AU) 2009-10-08 WO disclosed
EP-2074162-A2 RADIATION CURABLE AND JETTABLE INK COMPOSITIONS Hexion Specialty Chemicals Research Belgium S.A. (BE) 2009-07-01 EP disclosed
WO-2009048585-A1 RADIATION CURABLE AND JETTABLE INK COMPOSITIONS HEXION SPECIALTY CHEMICALS, INC (US) 2009-04-16 WO disclosed
WO-2008155507-A1 METHOD FOR TREATING THE SURFACE OF A SUBSTRATE BASED ON SULPHUR POLYMER, INTENDED TO BE COVERED WITH A COATING ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2008-12-24 WO disclosed
WO-2008045517-A2 RADIATION CURABLE AND JETTABLE INK COMPOSITIONS HEXION SPECIALTY CHEMICALS, INC. (US) 2008-04-17 WO disclosed
EP-1877839-A2 THERMOSETTING POLY(THIO)URETHANE FORMULATION COMPRISING AT LEAST ONE BLOCK COPOLYMER AND USE THEREOF IN OPTICS FOR THE PRODUCTION OF ORGANIC LENSES HAVING IMPROVED TOUGHNESS ESSILOR INTERNATIONAL Compagnie Générale d'Optique (FR) 2008-01-16 EP disclosed
EP-1771489-A1 POLYMERISABLE COMPOSITION CONTAINING AN ODOUR MASKING AGENT AND A PERFUME, AN OPTICAL LENS AND A PRODUCTION METHOD ESSILOR INTERNATIONAL (Compagnie Générale d'Optique) (FR) 2007-04-11 EP disclosed
WO-2006103371-A2 THERMOSETTING POLY(THIO)URETHANE FORMULATION COMPRISING AT LEAST ONE BLOCK COPOLYMER AND USE THEREOF IN OPTICS FOR THE PRODUCTION OF ORGANIC LENSES HAVING IMPROVED TOUGHNESS ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2006-10-05 WO disclosed
WO-2006005874-A1 POLYMERISABLE COMPOSITION CONTAINING AN ODOUR MASKING AGENT AND A PERFUME, AN OPTICAL LENS AND A PRODUCTION METHOD ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2006-01-19 WO disclosed
EP-0986767-A1 OPTICAL LENS IN TRANSPARENT ORGANIC POLYMER MATERIAL WITH HIGH REFRACTIVE INDEX AND HIGH ABBE NUMBER ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2000-03-22 EP disclosed
WO-1999052000-A1 OPTICAL LENS IN TRANSPARENT ORGANIC POLYMER MATERIAL WITH HIGH REFRACTIVE INDEX AND HIGH ABBE NUMBER ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 1999-10-14 WO disclosed