Delmopinol

Delmopinol

SCHEMBL308441

CCCC(CCC)CCCC1COCCN1CCO.Cl

nearest known ligand 0.33

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

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.33
TSHR P16473 1/20 0.32
PDK2 Q15119 1/20 0.30
PDK3 Q15120 1/20 0.30

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
Delmopinol SCHEMBL20299535 1.00 PDK1 (0.33) PDK1TSHRPDK2PDK3
Delmopinol SCHEMBL20298306 0.99 PDK1 (0.33) PDK1PDK2PDK3
Delmopinol SCHEMBL120704 0.99 PDK1 (0.33) PDK1PDK2PDK3
Delmopinol SCHEMBL9614970 0.97 PDK1 (0.31) PDK1TSHR
Delmopinol SCHEMBL23705764 0.97 PDK1 (0.33) PDK1PDK2PDK3
Delmopinol SCHEMBL23705768 0.97 PDK1 (0.33) PDK1PDK2PDK3
Delmopinol SCHEMBL23705767 0.97 PDK1 (0.33) PDK1PDK2PDK3
Delmopinol SCHEMBL23705763 0.97 PDK1 (0.33) PDK1PDK2PDK3
SCHEMBL10474211 0.93 PDK1 (0.32) PDK1TSHR
SCHEMBL10474877 0.91 GBA2 (0.32) PDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2931050-A1 BOTANICAL ANTIMICROBIAL COMPOSITIONS The Trustees of Columbia University in the City of New York (US) 2015-10-21 EP claimed
CN-104994878-A Botanical antimicrobial compositions UNIV COLUMBIA 2015-10-21 CN claimed
US-8999365-B2 Prevention of bacterial contamination SINCLAIR PHARMACEUTICALS LIMITED (GB) 2015-04-07 US claimed
WO-2014092999-A1 BOTANICAL ANTIMICROBIAL COMPOSITIONS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-06-19 WO claimed
US-20080299052-A1 Formulation to Prevent Plaque Formation SINCLAIR PHARMACEUTICALS LIMITED (GB) 2008-12-04 US claimed
CN-101175536-A Formulation to prevent plaque formation SINCLAIR PHARMACEUTICALS LTD (GB) 2008-05-07 CN claimed
EP-1879662-A1 FORMULATION TO PREVENT PLAQUE FORMATION Sinclair Pharmaceuticals Limited (GB) 2008-01-23 EP claimed
WO-2006120432-A1 FORMULATION TO PREVENT PLAQUE FORMATION SINCLAIR PHARMACEUTICALS LIMITED (GB) 2006-11-16 WO claimed
US-12458584-B2 Oral hygiene compositions for preventing the formation of oral biofilms and process for preparing the same ISP INVESTMENTS LLC (US) 2025-11-04 US disclosed
EP-3156057-B1 DELMOPINOL-COATED ANIMAL CHEW FOR USE IN THE PREVENTION OR TREATMENT OF HALITOSIS MAELOR LABORATORIES LTD (GB) 2023-10-04 EP disclosed
US-11660300-B2 Method of maintaining oral health in animals Boehringer Ingelheim Animal Health USA Inc. 2023-05-30 US disclosed
US-11578043-B2 Salt of delmopinol LUNDBECK PHARMACEUTICALS ITALY S.P.A. (IT) 2023-02-14 US disclosed
US-11384056-B2 Method for the manufacturing of delmopinol intermediates LUNDBECK PHARMACEUTICALS ITALY S.P.A. (IT) 2022-07-12 US disclosed
EP-3558952-B1 METHOD FOR THE MANUFACTURING OF DELMOPINOL AND OF ITS INTERMEDIATES LUNDBECK PHARMACEUTICALS ITALY S P A (IT) 2022-02-09 EP disclosed
US-5147632-A EDTA and derivatives, mouthwashes, toothpastes WARNER-LAMBERT COMPANY (US) 1992-09-15 US disclosed
WO-1992008442-A1 IMPROVED ANTI-PLAQUE COMPOSITIONS COMPRISING A COMBINATION OF MORPHOLINOAMINO ALCOHOL AND ANTI-MICROBIAL AGENT WARNER-LAMBERT COMPANY (US) 1992-05-29 WO disclosed
WO-1992008441-A1 IMPROVED ANTI-PLAQUE COMPOSITIONS COMPRISING A COMBINATION OF MORPHOLINOAMINO ALCOHOL AND METAL SALTS WARNER-LAMBERT COMPANY (US) 1992-05-29 WO disclosed
WO-1992007549-A1 IMPROVED ANTI-PLAQUE COMPOSITIONS COMPRISING A COMBINATION OF MORPHOLINOAMINO ALCOHOL AND ANTIBIOTIC WARNER-LAMBERT COMPANY (US) 1992-05-14 WO disclosed
WO-1992007548-A1 IMPROVED ANTI-PLAQUE COMPOSITIONS COMPRISING A COMBINATION OF MORPHOLINOAMINO ALCOHOL AND CHELATING AGENT WARNER-LAMBERT COMPANY (US) 1992-05-14 WO disclosed
US-5085850-A Bacterial destabilizing agent; tooth paste, mouth wash, chewing gum; non-staining WARNER-LAMBERT COMPANY (US) 1992-02-04 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 (4 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-12458584-B2 Oral hygiene compositions for preventing the formation of oral biofilms and process for preparing the same SMCHD1, TERB1, MLEC PDK1 3518/4885TSHR 3572/4885PDK2 3401/4885
US-11660300-B2 Method of maintaining oral health in animals O60361, MRM1, MSMO1 PDK1 3914/4885TSHR 2666/4885PDK2 2781/4885
US-11578043-B2 Salt of delmopinol DNM1L, MCOLN1, IMPA1 PDK1 2598/4885TSHR 2774/4885PDK2 3485/4885
US-11384056-B2 Method for the manufacturing of delmopinol intermediates THOP1, PTMS, CYP4A11 PDK1 2573/4885TSHR 547/4885PDK2 3476/4885

“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.