Benzethonium

Benzethonium

SCHEMBL1282115

CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1.Cl

nearest known ligand 0.98

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 Benzethonium. 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
ERBB2 known ✓ P04626 2/20 0.98
CHRM2 known ✓ P08172 2/20 0.98
CHRM4 known ✓ P08173 2/20 0.98
CHRM5 known ✓ P08912 2/20 0.98
ADRA2A known ✓ P08913 2/20 0.98
CHRM1 known ✓ P11229 2/20 0.98
ADRA2B known ✓ P18089 2/20 0.98
ADRA2C known ✓ P18825 2/20 0.98
CHRM3 known ✓ P20309 2/20 0.98
ACHE known ✓ P22303 2/20 0.98
SLC6A2 known ✓ P23975 2/20 0.98
HTR2A known ✓ P28223 2/20 0.98
HTR2C known ✓ P28335 2/20 0.98
SLC6A4 known ✓ P31645 2/20 0.98
SLC6A3 known ✓ Q01959 2/20 0.98
KCNH2 known ✓ Q12809 2/20 0.98
ESR1 known ✓ P03372 1/20 0.98
NR3C1 known ✓ P04150 1/20 0.98
ADRB2 known ✓ P07550 1/20 0.98
ADRB1 known ✓ P08588 1/20 0.98

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
Benzethonium SCHEMBL22711570 1.00 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL7271853 0.99 SMN1; SMN2 (0.95) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL122985 0.99 SMN1; SMN2 (1.00) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL976365 0.98 SMN1; SMN2 (0.96) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL4418328 0.98 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL927612 0.98 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL1672928 0.98 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL5549294 0.98 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL27797280 0.98 SMN1; SMN2 (1.00) SMN1; SMN2HIF1ALMNATSHRTDP1
Benzethonium SCHEMBL1951703 0.98 SMN1; SMN2 (0.98) SMN1; SMN2HIF1ALMNATSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007133220-A1 WOOD PRESERVATIVE JENEVEIN EARL (US) 2007-11-22 WO claimed
US-20060189497-A1 Wood preservative JENEVEIN EARL 2006-08-24 US claimed
US-7045492-B2 Cleaning composition comprising cationic surfactants, chelant, and an alcohol solvent mixture Jenevein, Earl (US) 2006-05-16 US claimed
US-20040162230-A1 Cleaning composition and a method of making thereof JENEVEIN, EARL 2004-08-19 US claimed
EP-4744113-A2 ELECTRODES FOR ENERGY STORAGE DEVICES Nanoramic, Inc. (US) 2026-05-20 EP disclosed
WO-2025014921-A9 ELECTRODES FOR ENERGY STORAGE DEVICES FASTCAP SYSTEMS CORPORATION (US) 2025-10-16 WO disclosed
EP-4599485-A1 ELECTRODES FOR ENERGY STORAGE DEVICES Nanoramic, Inc. (US) 2025-08-13 EP disclosed
CN-116023323-B Preparation method of avibactam intermediate 浙江工业大学 2025-06-17 CN disclosed
US-20250192187-A1 ENERGY STORAGE DEVICE NANORAMIC, INC. 2025-06-12 US disclosed
WO-2025101774-A1 ELECTRODES FOR ENERGY STORAGE DEVICES FASTCAP SYSTEMS CORPORATION (US) 2025-05-15 WO disclosed
WO-2025014921-A2 ELECTRODES FOR ENERGY STORAGE DEVICES FASTCAP SYSTEMS CORPORATION (US) 2025-01-16 WO disclosed
EP-4487356-A1 ENERGY STORAGE DEVICE Fastcap Systems Corporation (US) 2025-01-08 EP disclosed
US-20050143467-A1 Stimulation of cpt-1 as a means to reduce weight THE JOHNS HOPKINS UNIVERSITY SCHOOL OF MEDICINE LICENSING AND TECHNOLOGY DEVELOPMENT (US) 2005-06-30 US disclosed
US-20050106217-A1 Stimulation of CPT-1 as a means to reduce weight JOHNS HOPKINS UNIVERSITY LICENSING AND TECHNOLOGY DEVELOPMENT (US) 2005-05-19 US disclosed
EP-1471906-A1 STIMULATION OF CPT-1 AS A MEANS TO REDUCE WEIGHT Johns Hopkins University School of Medicine (US) 2004-11-03 EP disclosed
US-20040162230-A1 Cleaning composition and a method of making thereof JENEVEIN, EARL 2004-08-19 US disclosed
US-20040162230-A1 Cleaning composition and a method of making thereof JENEVEIN, EARL 2004-08-19 US disclosed
WO-2003066043-A1 STIMULATION OF CPT-1 AS A MEANS TO REDUCE WEIGHT JOHN HOPKINS UNIVERSITY SCHOOL OF MEDICINE (US) 2003-08-14 WO disclosed
US-RE30309-E N-Alkyl-3-pyridinium-methanol fluorides and derivatives thereof PIERRE FABRE S.A. (FR) 1980-06-17 US disclosed
US-4098879-A DENTIFRICES AND ANTICARIES AGENTS PIERRE FABRE S.A. (FR) 1978-07-04 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-20050106217-A1 Stimulation of CPT-1 as a means to reduce weight CPT1B, CPT1A, CPT2 ERBB2 4521/4885CHRM2 2048/4885CHRM4 1914/4885
US-20050143467-A1 Stimulation of cpt-1 as a means to reduce weight CPT1B, CPT1A, CPT2 ERBB2 4521/4885CHRM2 2048/4885CHRM4 1914/4885

“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.