Octenidine

Octenidine

SCHEMBL126065

CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.Cl.Cl

nearest known ligand 0.54

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 Octenidine. 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
HSP90AA1 known ✓ P07900 2/20 0.54
KCNA3 known ✓ P22001 3/20 0.36
PTGS1 known ✓ P23219 3/20 0.34
PTGS2 known ✓ P35354 3/20 0.34
NPC1 O15118 7/20 0.54
RAB9A P51151 7/20 0.54
HTT P42858 6/20 0.54
MAPK1 P28482 4/20 0.54
LMNA P02545 3/20 0.54
NPSR1 Q6W5P4 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
GALR3 O60755 2/20 0.54
POLB P06746 2/20 0.54
ATM Q13315 2/20 0.54
APOBEC3A P31941 2/20 0.54
APOBEC3G Q9HC16 2/20 0.54
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
RAD52 P43351 1/20 0.54
PAX8 Q06710 1/20 0.54

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
Octenidine SCHEMBL986183 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL8824299 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Hydrochloric Acid SCHEMBL10573899 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL126751 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Hydrochloric Acid SCHEMBL10573221 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Pirtenidine SCHEMBL10344101 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL16836483 1.00 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL23393769 0.98 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL10569601 0.98 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL10570053 0.98 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA

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

Appears in 6430 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4736643-A1 BIOFILM GERMICIDE COMPOSITION Kao Corporation (JP) 2026-05-06 EP claimed
EP-4736644-A1 BIOFILM REMOVER COMPOSITION Kao Corporation (JP) 2026-05-06 EP claimed
US-12618001-B2 Ultra-lightweight proppants SAUDI ARABIAN OIL COMPANY (SA) 2026-05-05 US claimed
EP-3771337-B1 ANTIMICROBIAL COMPOSITION PROCTER & GAMBLE (US) 2026-04-29 EP claimed
EP-4732832-A1 HIGHLY LOADED METAL OXIDE MATERIALS BY SELF-ASSEMBLY FOR EXTENDED BIOLOGICALLY ACTIVE MOLECULE RELEASE IN MEDICAL AND DENTAL APPLICATIONS Mesosil Inc. (CA) 2026-04-29 EP claimed
EP-4727514-A1 DEODORANT COMPOSITIONS COMPRISING CARBOXYLIC ACIDS The Procter & Gamble Company (US) 2026-04-22 EP claimed
US-20260101902-A1 LIQUID ANTIMICROBIAL COMPOSITION GAMA HEALTHCARE LTD (GB) 2026-04-16 US claimed
EP-4717285-A2 WOUND IRRIGATION DEVICES AND METHODS FOR DELIVERING SYNERGISTIC ACTIVE AGENTS Irrimax Corporation (US) 2026-04-01 EP claimed
EP-4598608-B1 WOUND IRRIGATION DEVICES AND METHODS FOR DELIVERING SYNERGISTIC ACTIVE AGENTS IRRIMAX CORP (US) 2026-03-25 EP claimed
US-20260078012-A1 NANOPARTICLE COMPOSITION AND METHOD OF USE AND MANUFACTURE VERTELOVA REGINA (US) 2026-03-19 US claimed
WO-2001005360-A2 DISINFECTING SHAVING AGENT HENKEL ECOLAB GMBH & CO. OHG (DE) 2001-01-25 WO claimed
EP-0966511-A2 WASHING DISINFECTANT FOR HYGIENIC AND SURGICAL HAND DISINFECTION AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 1999-12-29 EP claimed
EP-0958344-A2 COMPOSITIONS FOR DISINFECTION OF SKIN AND MUCOUS MEMBRANE AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 1999-11-24 EP claimed
EP-0252278-B1 Disinfecting agents and their use in disinfecting the skin and mucous membranes HENKEL KGAA (DE) 1998-08-19 EP claimed
WO-1998020094-A2 COMPOSITIONS FOR DISINFECTION OF SKIN AND MUCOUS MEMBRANE AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 1998-05-14 WO claimed
WO-1998020095-A2 WASHING DISINFECTANT FOR HYGIENIC AND SURGICAL HAND DISINFECTION AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 1998-05-14 WO claimed
EP-0252278-A2 Disinfecting agents and their use in disinfecting the skin and mucous membranes Henkel Kommanditgesellschaft auf Aktien (DE) 1988-01-13 EP claimed
EP-0161425-A2 Antimicrobial surface degerming compositions STERLING DRUG INC. (US) 1985-11-21 EP claimed
EP-0161426-A1 Antimicrobial surface degerming compositions STERLING DRUG INC. (US) 1985-11-21 EP claimed
US-4542125-A BACTERICIDE FOR BOVINE MISTITIS STERLING DRUG INC. (US) 1985-09-17 US claimed