Octenidine

Octenidine

SCHEMBL454087

CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.[Cl-].[Cl-].[H+].[H+]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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
NPC1 O15118 7/20 0.53
RAB9A P51151 7/20 0.53
HTT P42858 6/20 0.53
MAPK1 P28482 4/20 0.53
LMNA P02545 3/20 0.53
NPSR1 Q6W5P4 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
GALR3 O60755 2/20 0.53
POLB P06746 2/20 0.53
ATM Q13315 2/20 0.53
APOBEC3A P31941 2/20 0.53
APOBEC3G Q9HC16 2/20 0.53
HSP90AA1 P07900 2/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
RAD52 P43351 1/20 0.53
PAX8 Q06710 1/20 0.53
NR2F2 P24468 1/20 0.53
NOD2 Q9HC29 1/20 0.53
ALDH1A1 P00352 2/20 0.50

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 SCHEMBL2594550 0.98 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL20764598 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
Pirtenidine SCHEMBL2108103 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL10570053 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL10569601 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
SCHEMBL23393769 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL124821 0.97 NPC1 (0.56) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL16836483 0.95 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Hydrochloric Acid SCHEMBL10573221 0.95 NPC1 (0.54) NPC1RAB9AHTTMAPK1LMNA
Octenidine SCHEMBL20597431 0.95 NPC1 (0.59) 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

Claimed or disclosed in 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4736644-A1 BIOFILM REMOVER COMPOSITION Kao Corporation (JP) 2026-05-06 EP disclosed
EP-4736643-A1 BIOFILM GERMICIDE COMPOSITION Kao Corporation (JP) 2026-05-06 EP disclosed
EP-3771337-B1 ANTIMICROBIAL COMPOSITION PROCTER & GAMBLE (US) 2026-04-29 EP disclosed
US-20260102359-A1 COMBINATION TREATMENT OF DERMAL AND TRANSDERMAL FIBROTIC DISEASES, DISORDERS AND ASSOCIATED PAIN AND INFLAMMATION ERESINA LLC (US) 2026-04-16 US disclosed
WO-2025121754-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING SKIN DISEASES COMPRISING JANUS KINASE INHIBITOR 장병모 2025-06-12 WO disclosed
WO-2025110651-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING SKIN DISEASES 장병모 2025-05-30 WO disclosed
WO-2025100865-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING PSORIASIS AND ATOPIC DERMATITIS 장병모 2025-05-15 WO disclosed
CN-119923247-A Compositions with improved SPF and UVA photoprotection 西姆莱斯股份公司 2025-05-02 CN disclosed
WO-2025004478-A1 BIOFILM GERMICIDE COMPOSITION 花王株式会社 2025-01-02 WO disclosed
WO-2025004479-A1 BIOFILM REMOVER COMPOSITION 花王株式会社 2025-01-02 WO disclosed
EP-2113237-B1 Dental materials with anti-plaque agents HERAEUS KULZER GMBH (DE) 2014-12-10 EP disclosed
WO-2014153238-A9 COMPOSITIONS, METHODS AND DEVICES FOR PROMOTING WOUND HEALING AND REDUCING INFECTION IASIS MOLECULAR SCIENCES (US) 2014-12-04 WO disclosed
WO-2014153238-A2 COMPOSITIONS, METHODS AND DEVICES FOR PROMOTING WOUND HEALING AND REDUCING INFECTION IASIS MOLECULAR SCIENCES (US) 2014-09-25 WO disclosed
EP-2613758-A2 MACROEMULSIONS WITH IMPROVED DEODORANT EFFICACY Beiersdorf AG (DE) 2013-07-17 EP disclosed
WO-2012031987-A2 OCTENIDINE DIHYDROCHLORIDE AS CO-EMULSIFIER IN MICROEMULSIONS BEIERSDORF AG (DE) 2012-03-15 WO disclosed
WO-2012031984-A2 MACROEMULSIONS WITH IMPROVED DEODORANT EFFICACY BEIERSDORF AG (DE) 2012-03-15 WO disclosed
US-7927613-B2 Pharmaceutical co-crystal compositions UNIVERSITY OF SOUTH FLORIDA (US) 2011-04-19 US disclosed
US-7790905-B2 Pharmaceutical propylene glycol solvate compositions MCNEIL-PPC, INC. (US) 2010-09-07 US disclosed
US-20090297458-A1 Dental materials equipped with active anti-plaque substance(s) HERAEUS KULZER GMBH (DE) 2009-12-03 US disclosed
EP-2113237-A1 Dental materials with anti-plaque agents Heraeus Kulzer GmbH (DE) 2009-11-04 EP 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 (1 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-20260102359-A1 COMBINATION TREATMENT OF DERMAL AND TRANSDERMAL FIBROTIC DISEASES, DISORDERS AND ASSOCIATED PAIN AND INFLAMMATION COL2A1, COLGALT1, PLOD3 NPC1 3898/4885RAB9A 4780/4885HTT 3284/4885

“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.