O-Xylene

O-Xylene

SCHEMBL577139

Cc1ccccc1C.Cc1ccccc1C.Cl.Cl

nearest known ligand 0.91

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 3/20 0.91
CA2 known ✓ P00918 2/20 0.53
ESR1 known ✓ P03372 1/20 0.43
TSHR P16473 4/20 0.91
CYP3A4 P08684 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 4/20 0.53
CA1 P00915 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CYP1A2 P05177 2/20 0.50
CYP2A6 P11509 2/20 0.50
LMNA P02545 1/20 0.47
ALOX12 P18054 1/20 0.47
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
TAAR1 Q96RJ0 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TRPA1 O75762 1/20 0.40
CD44 P16070 1/20 0.40

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
O-Xylene SCHEMBL7935899 1.00
O-Xylene SCHEMBL11483821 1.00 TSHR (0.91) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL577141 1.00 TSHR (0.91) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL30211079 1.00 TSHR (0.91) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL15021872 1.00 TSHR (0.91) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL577140 1.00
O-Xylene SCHEMBL3251065 1.00 TSHR (0.91) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL3167517 0.96 TSHR (0.83) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL27310124 0.96 TSHR (0.83) TSHRACHECYP3A4TDP1ALDH1A1
O-Xylene SCHEMBL27899298 0.96 TSHR (0.83) TSHRACHECYP3A4TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
US-10435543-B2 Rubber or elastomer compositions and processes for their manufacturing LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2019-10-08 US claimed
US-20170342240-A1 RUBBER OR ELASTOMER COMPOSITIONS AND PROCESSES FOR THEIR MANUFACTURING LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2017-11-30 US claimed
JP-57047328-A None JP disclosed
JP-9278771-A None JP disclosed
JP-9278772-A None JP disclosed
US-20250380940-A1 BONE DISTRACTION DEVICES AND METHODS OF USING SAME NUVASIVE INC (US) 2025-12-18 US disclosed
US-12419626-B2 Bone distraction devices and methods of using same NUVASIVE, INC. (US) 2025-09-23 US disclosed
US-20240341743-A1 BONE DISTRACTION DEVICES AND METHODS OF USING SAME NUVASIVE, INC. 2024-10-17 US disclosed
US-12044416-B2 Energy efficient enclosure temperature regulation system CERES GREENHOUSE SOLUTIONS LLC (US) 2024-07-23 US disclosed
EP-0834497-B1 PROCESS FOR PRODUCING 3-ISOCHROMANONES SAGAMI CHEM RES (JP) 2001-10-24 EP disclosed
US-6046299-A MAKING A DYE FIXING AGENT QUATERNARY CATIONIC POLYMER BY REACTING DI-TERTIARY AMINE(S) WITH XYLENE DIHALIDE(S) OF GIVEN FORMULAS; EXCELLENT INK DYE FIXABILITY, AND IMPROVES WATER RESISTANCE OF THE PRINTED MATTER NICCA CHEMICAL CO., LTD. (JP) 2000-04-04 US disclosed
US-5886211-A Process for producing 2-(halomethyl)phenylacetic acid esters SAGAMI CHEMICAL RESEARCH CENTER (JP) 1999-03-23 US disclosed
EP-0834497-A1 PROCESS FOR PRODUCING 2-(HALOMETHYL)PHENYLACETIC ACID ESTERS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1998-04-08 EP disclosed
EP-0818458-A1 TRANSITION METAL COMPOUND, POLYMERIZATION CATALYST FOR OLEFINS, AND PROCESS FOR PRODUCING OLEFINIC POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-01-14 EP disclosed
JP-H09278772-A PRODUCTION OF 3-ISOCHROMANONES SAGAMI CHEM RES CENTER 1997-10-28 JP disclosed
JP-H09278771-A PRODUCTION OF 3-ISOCHROMANONES SAGAMI CHEM RES CENTER 1997-10-28 JP disclosed
JP-S5747328-A NOVEL POLYETHER RESIN AND ITS PRODUCTION KANEGAFUCHI CHEM IND CO LTD 1982-03-18 JP disclosed