Quinoxaline

Quinoxaline

SCHEMBL2431603

Cl.c1ccc2nccnc2c1

nearest known ligand 0.55

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 Quinoxaline. 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
CCR5 known ✓ P51681 1/20 0.40
HTR1A known ✓ P08908 1/20 0.39
ADRA1D known ✓ P25100 1/20 0.39
ADRA1A known ✓ P35348 1/20 0.39
ADRA1B known ✓ P35368 1/20 0.39
GLA known ✓ P06280 1/20 0.38
ACHE known ✓ P22303 1/20 0.38
GAA known ✓ P10253 1/20 0.38
ALDH1A1 P00352 4/20 0.55
MAPT P10636 5/20 0.47
NCF1 P14598 1/20 0.46
KDM4E B2RXH2 4/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.42
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CCR1 P32246 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
Quinoxaline SCHEMBL27507035 1.00 ALDH1A1 (0.55) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL29612255 1.00 ALDH1A1 (0.55) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL27705598 0.97 ALDH1A1 (0.52) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL27863276 0.97 ALDH1A1 (0.52) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL6928518 0.96 ALDH1A1 (0.58) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL5315 0.96 ALDH1A1 (0.58) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL30320908 0.96 ALDH1A1 (0.58) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL29355228 0.96 ALDH1A1 (0.58) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL4000710 0.93 ALDH1A1 (0.55) ALDH1A1MAPTNCF1KDM4EPOLB
Quinoxaline SCHEMBL19877228 0.93 ALDH1A1 (0.55) ALDH1A1MAPTNCF1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957138-A Quinoxaline asymmetric hydrogenation method 哈尔滨工业大学(深圳) 2022-08-30 CN claimed
CN-109962289-B Electrolyte composition and metal ion battery comprising same 财团法人工业技术研究院 2022-03-11 CN claimed
US-10587009-B2 Electrolyte composition and metal-ion battery employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2020-03-10 US claimed
US-10367227-B2 Electrolyte composition and metal-ion battery employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-07-30 US claimed
US-20190198929-A1 ELECTROLYTE COMPOSITION AND METAL-ION BATTERY EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2019-06-27 US claimed
US-20180219257-A1 ALUMINUM-ION BATTERY INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2018-08-02 US claimed
CN-106336415-B A kind of 1,2,4- triazole derivatives of chloride benzopyrazines structure and its preparation method and application 浙江工业大学 2018-05-29 CN claimed
US-20170358815-A1 ELECTROLYTE COMPOSITION AND METAL-ION BATTERY EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-12-14 US claimed
CN-106336415-A 1,2,4-triazole derivative containing chlorobenzopyrazine structure and preparation method and application thereof 浙江工业大学 2017-01-18 CN claimed
CN-106243048-A A kind of hydrazone compounds of chloride benzopyrazines structure and preparation method and application 浙江工业大学 2016-12-21 CN claimed
CN-106220633-A 1,2,4 triazole derivatives of a kind of chloride benzopyrazines structure are as the application of antibacterial 浙江工业大学 2016-12-14 CN claimed
CN-106172418-A The hydrazone compounds of a kind of chloride benzopyrazines structure is as the application of antibacterial 浙江工业大学 2016-12-07 CN claimed
CN-1285834-A Fused pyrazine compound ONO PHARMACEUTICAL CO (JP) 2001-02-28 CN claimed
US-12384789-B2 Compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2025-08-12 US disclosed
US-11845745-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment Clavius Pharmaceuticals, LLC. (US) 2023-12-19 US disclosed
CN-114957138-A Quinoxaline asymmetric hydrogenation method 哈尔滨工业大学(深圳) 2022-08-30 CN disclosed
CN-1342151-A Quinoline and quinoxaline compounds AVENTIS PHARM PROD INC (US) 2002-03-27 CN disclosed
CN-1286683-A Tetrahydrobenzindole derivatives MEIJI SEIKA KAISHA (JP) 2001-03-07 CN disclosed
CN-1285834-A Fused pyrazine compound ONO PHARMACEUTICAL CO (JP) 2001-02-28 CN disclosed
US-4973736-A Diethers of m- or p-hydroxyphenol BASF AKTIENGESELLSCHAFT (DE) 1990-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11845745-B2 Tri-substituted imidazoles for the inhibition of TGF beta and methods of treatment TGFB1, TGFBR1, TGFB2 CCR5 531/4885HTR1A 1658/4885ADRA1D 289/4885
US-12384789-B2 Compounds for treating Huntington's disease HTT, HYPK, FH CCR5 4446/4885HTR1A 406/4885ADRA1D 3998/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.