M-Xylene

M-Xylene

SCHEMBL1833203

Cc1cccc(C)c1.Cc1cccc(C)c1.Cc1cccc(C)c1.Cc1cccc(C)c1.Cc1cccc(C)c1.Cc1cccc(C)c1.Cl.Cl.Cl.Cl.Cl.Cl

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of M-Xylene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 6/20 0.92
PARP1 known ✓ P09874 1/20 0.46
HTR3E known ✓ A5X5Y0 1/20 0.44
HTR3B known ✓ O95264 1/20 0.44
HTR3A known ✓ P46098 1/20 0.44
HTR3D known ✓ Q70Z44 1/20 0.44
HTR3C known ✓ Q8WXA8 1/20 0.44
ALDH1A1 P00352 2/20 0.58
MAPK1 P28482 1/20 0.58
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.50
ALOX12 P18054 1/20 0.50
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
IDO1 P14902 1/20 0.48
CYP1A2 P05177 2/20 0.48
NPC1 O15118 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48

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
M-Xylene SCHEMBL6838834 1.00
M-Xylene SCHEMBL31500493 1.00 ACHE (0.92) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL1833208 1.00 ACHE (0.92) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL6838832 1.00 ACHE (0.92) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL8140418 1.00 ACHE (0.92) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL28365822 0.96 ACHE (0.86) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL6019078 0.96 ACHE (0.86) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL11598111 0.96 ACHE (0.86) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL891494 0.96 ACHE (1.00) ACHEALDH1A1MAPK1TSHRLMNA
M-Xylene SCHEMBL6397624 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024253093-A1 FLUOROSILICONE COMPOUND ダイキン工業株式会社 2024-12-12 WO disclosed
US-12065594-B2 Roll and method for producing roll LINTEC CORPORATION (JP) 2024-08-20 US disclosed
US-11220091-B2 Roll and method for producing roll LINTEC CORPORATION (JP) 2022-01-11 US disclosed
US-20200062999-A1 ROLL AND METHOD FOR PRODUCING ROLL LINTEC CORPORATION (JP) 2020-02-27 US disclosed
US-10479056-B2 Print protection film LINTEC CORPORATION (JP) 2019-11-19 US disclosed
US-20180079187-A1 PAINT PROTECTION FILM LINTEC CORPORATION (JP) 2018-03-22 US disclosed
CN-104526931-A Fluorosilicone mold release composition DAIKIN IND LTD 2015-04-22 CN disclosed
EP-2029340-B1 FLUOROSILICONE MOLD RELEASE COMPOSITION DAIKIN IND LTD (JP) 2014-09-24 EP disclosed
US-8497340-B2 Fluorosilicone mold release composition DAIKIN INDUSTRIES, LTD. (JP) 2013-07-30 US disclosed
EP-2078765-B1 VAPOR DEPOSITION MATERIAL, PROCESS FOR PRODUCING OPTICAL MEMBER OR PLASTIC LENS FOR SPECTACLE WITH USE THEREOF, AND PLASTIC LENS FOR SPECTACLE HOYA CORP (JP) 2011-05-11 EP disclosed
US-6939613-B2 Optical member, process of producing optical member, and process of producing thin film HOYA CORPORATION (JP) 2005-09-06 US disclosed
US-6929822-B2 Method for manufacturing optical member having water-repellent thin film HOYA CORPORATION (JP) 2005-08-16 US disclosed
JP-2005082714-A WATER REPELLENT FINE TECHNOLOGY:KK 2005-03-31 JP disclosed
US-20030207089-A1 Electrophotographic image-receiving sheet, process for manufacturing the same, and process for image formation using the same FUJI PHOTO FILM CO., LTD. 2003-11-06 US disclosed
EP-1351071-A2 Optical member with antireflection film and water-repellent layer and production processes HOYA CORPORATION (JP) 2003-10-08 EP disclosed
CN-1445562-A Optical element and its production method and method for producing film HOYA CORP (JP) 2003-10-01 CN disclosed
US-20030181044-A1 Optical member, process of producing optical member, and process of producing thin film HOYA CORPORATION 2003-09-25 US disclosed
US-20030003227-A1 Method for manufacturing optical member having water-repellent thin film HOYA CORPORATION (JP) 2003-01-02 US disclosed
EP-1255129-A2 Method for manufacturing optical member having water-repellent thin film HOYA CORPORATION (JP) 2002-11-06 EP disclosed
US-5358996-A Contains perfluoroalkyl group and at least one terminal has a silicon-containing organic group SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-10-25 US disclosed