Octenidine

Octenidine

SCHEMBL20765367

CC(=O)O.CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 6/20 0.47
RAB9A P51151 6/20 0.47
HTT P42858 6/20 0.47
LMNA P02545 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
GALR3 O60755 2/20 0.47
POLB P06746 2/20 0.47
ATM Q13315 2/20 0.47
MAPK1 P28482 2/20 0.47
APOBEC3A P31941 2/20 0.47
APOBEC3G Q9HC16 2/20 0.47
HSP90AA1 P07900 2/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPT P10636 1/20 0.47
RAD52 P43351 1/20 0.47
PAX8 Q06710 1/20 0.47
NR2F2 P24468 1/20 0.47
NOD2 Q9HC29 1/20 0.47
ALDH1A1 P00352 1/20 0.45

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 SCHEMBL20764598 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
Octenidine SCHEMBL124821 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
Pirtenidine SCHEMBL2108103 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL10569601 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL10570053 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
SCHEMBL23393769 0.91 NPC1 (0.56) NPC1RAB9AHTTLMNASMN1; SMN2
Octenidine SCHEMBL20765563 0.90 GPR84 (0.46) NPC1RAB9AHTTLMNASMN1; SMN2
Octenidine SCHEMBL28384589 0.90 GPR84 (0.46) NPC1RAB9AHTTLMNASMN1; SMN2
Octenidine SCHEMBL13834162 0.90 GPR84 (0.46) NPC1RAB9AHTTLMNASMN1; SMN2
Octenidine SCHEMBL20765382 0.90 NPC1 (0.44) NPC1RAB9AHTTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113874460-B Adhesive composition 3M创新有限公司 2024-02-23 CN claimed
US-20220298389-A1 ADHESIVE COMPOSITIONS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2022-09-22 US claimed
US-20220105018-A1 ANTIMICROBIAL COMPOSITION SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2022-04-07 US claimed
EP-3976121-A1 ADHESIVE COMPOSITIONS 3M Innovative Properties Company (US) 2022-04-06 EP claimed
EP-3946233-A1 ANTIMICROBIAL COMPOSITION 3M Innovative Properties Company (US) 2022-02-09 EP claimed
CN-113874460-A Adhesive composition 3M创新有限公司 2021-12-31 CN claimed
CN-113645946-A Antimicrobial compositions 3M创新有限公司 2021-11-12 CN claimed
US-11014907-B2 Octendidine based compounds DISHMAN CARBOGEN AMCIS LTD. (IN) 2021-05-25 US claimed
US-20200377471-A1 OCTENDIDINE BASED COMPOUNDS DISHMAN CARBOGEN AMCIS LTD. (IN) 2020-12-03 US claimed
WO-2020240337-A1 ADHESIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-12-03 WO claimed
WO-2020201945-A1 ANTIMICROBIAL COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2020-10-08 WO claimed
EP-3672942-A1 OCTENIDINE BASED COMPOUNDS Dishman Carbogen Amcis Ltd. (IN) 2020-07-01 EP claimed
CN-111051285-A Octenidine-based compounds 迪氏曼卡博金艾美斯有限公司 2020-04-21 CN claimed
WO-2019038669-A1 OCTENIDINE BASED COMPOUNDS DISHMAN CARBOGEN AMCIS LTD. (IN) 2019-02-28 WO claimed
CN-113874460-B Adhesive composition 3M创新有限公司 2024-02-23 CN disclosed
US-20220298389-A1 ADHESIVE COMPOSITIONS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2022-09-22 US disclosed
US-20220218869-A1 SPRAYABLE ANTIMICROBIAL COATINGS FOR WOUND TREATMENTS 3M INNOVATIVE PROPERTIES CO (US) 2022-07-14 US disclosed
EP-3672942-A1 OCTENIDINE BASED COMPOUNDS Dishman Carbogen Amcis Ltd. (IN) 2020-07-01 EP disclosed
CN-111051285-A Octenidine-based compounds 迪氏曼卡博金艾美斯有限公司 2020-04-21 CN disclosed
WO-2019038669-A1 OCTENIDINE BASED COMPOUNDS DISHMAN CARBOGEN AMCIS LTD. (IN) 2019-02-28 WO 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-20200377471-A1 OCTENDIDINE BASED COMPOUNDS SSTR5, SSTR4, SSTR3 NPC1 1145/4885RAB9A 1905/4885HTT 493/4885
US-11014907-B2 Octendidine based compounds SSTR5, SSTR4, SSTR3 NPC1 1145/4885RAB9A 1905/4885HTT 493/4885

“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.