O-Xylene

O-Xylene

SCHEMBL577140

Cc1ccccc1C.Cl

nearest known ligand 0.00

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 O-Xylene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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
O-Xylene SCHEMBL7935899 1.00
O-Xylene SCHEMBL11483821 1.00 TSHR (0.91)
O-Xylene SCHEMBL577141 1.00 TSHR (0.91)
O-Xylene SCHEMBL30211079 1.00 TSHR (0.91)
O-Xylene SCHEMBL15021872 1.00 TSHR (0.91)
O-Xylene SCHEMBL577139 1.00 TSHR (0.91)
O-Xylene SCHEMBL3251065 1.00 TSHR (0.91)
O-Xylene SCHEMBL3167517 0.96 TSHR (0.83)
O-Xylene SCHEMBL27310124 0.96 TSHR (0.83)
O-Xylene SCHEMBL27899298 0.96 TSHR (0.83)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119842078-A Polysulfone resin, preparation method thereof and polymer product 深圳市沃特新材料股份有限公司 2025-04-18 CN claimed
CN-116063260-B Continuous oxidation process of chloro-o-xylene 中化学科学技术研究有限公司 2025-03-18 CN claimed
CN-116063260-A Continuous oxidation process of chloro-o-xylene 中化学科学技术研究有限公司 2023-05-05 CN claimed
US-20210292551-A1 THREE-DIMENSIONAL LATTICE STRUCTURES CONTAINING OPERATING MATERIAL, COMPOSITIONS COMPRISING THE SAME, AND COMPOSITIONS AND METHODS FOR MAKING THE SAME BROWN JAMES F (US) 2021-09-23 US claimed
CN-113195675-A Thermal storage using phase change materials coated with nanoparticles 盐储能技术公司 2021-07-30 CN claimed
EP-3830162-A1 THREE-DIMENSIONAL LATTICE STRUCTURES CONTAINING OPERATING MATERIAL, COMPOSITIONS COMPRISING THE SAME, AND COMPOSITIONS AND METHODS FOR MAKING THE SAME Brown, James F. (US) 2021-06-09 EP claimed
EP-3824041-A1 HEAT STORAGE USING PHASE CHANGE MATERIAL COATED WITH NANOPARTICLES SaltX Technology AB (SE) 2021-05-26 EP claimed
WO-2020127078-A1 HEAT STORAGE USING PHASE CHANGE MATERIAL COATED WITH NANOPARTICLES SALTX TECHNOLOGY AB (SE) 2020-06-25 WO claimed
WO-2020028136-A1 THREE-DIMENSIONAL LATTICE STRUCTURES CONTAINING OPERATING MATERIAL, COMPOSITIONS COMPRISING THE SAME, AND COMPOSITIONS AND METHODS FOR MAKING THE SAME BROWN JAMES F (US) 2020-02-06 WO claimed
CN-110419538-A A kind of efficiently durable furniture pest repellant UNIV FOSHAN 2019-11-08 CN claimed
CN-101671276-B Method for recovering phosgene in continuous production process of toluene di-isocyanate SEDIN ENGINEERING CO LTD 2011-10-26 CN claimed
CN-101735109-A Method for continuously producing organic isocyanate SEDIN ENGINEERING CO LTD 2010-06-16 CN claimed
CN-101735110-A Method for preparing organic isocyanate by using injection circulation reactor SEDIN ENGINEERING CO LTD 2010-06-16 CN claimed
CN-101708438-A Mixer and method for preparing organic isocyanate SEDIN ENGINEERING CO LTD 2010-05-19 CN claimed
CN-101671273-A Method for recycling phosgene in continuous production process of toluene di-isocyanate UNIV TIANJIN 2010-03-17 CN claimed
CN-101671275-A Method for continuously manufacturing toluene di-isocyanate SEDIN ENGINEERING CO LTD 2010-03-17 CN claimed
CN-101671274-A Method for recycling phosgene in continuous production process of toluene di-isocyanate UNIV TIANJIN 2010-03-17 CN claimed
CN-101671276-A Method for recovering phosgene in continuous production process of toluene di-isocyanate SEDIN ENGINEERING CO LTD 2010-03-17 CN claimed
CN-101492341-A Process for producing saturated polychloralkane HAIZHEN YANG (CN) 2009-07-29 CN claimed
US-4328374-A Process for the production of aromatic dialdehydes MITSUBISHI GAS CHEMICAL CO., INC. (JP) 1982-05-04 US claimed