SCHEMBL701872

SCHEMBL701872

CCCCCCCCCCCC[N+](CCCCCCCCCCCC)(CCCCCCCCCCCC)CCCCCCCCCCCC.Clc1ccc([B-](c2ccc(Cl)cc2)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.58
SLC22A1 O15245 2/20 0.48
TSHR P16473 2/20 0.46
HIF1A Q16665 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SLC22A2 O15244 1/20 0.44
DNM1 Q05193 4/20 0.43
LMNA P02545 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL15537163 1.00 KCNH2 (0.58) KCNH2SLC22A1TSHRHIF1AALDH1A1
Tetrahexylammonium SCHEMBL5052852 1.00 KCNH2 (0.58) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL15537986 1.00 KCNH2 (0.58) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL6364751 1.00 KCNH2 (0.58) KCNH2SLC22A1TSHRHIF1AALDH1A1
Tetrabuthylammonium SCHEMBL15537506 0.94 KCNH2 (0.51) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL15539393 0.89 KCNH2 (0.47) KCNH2TP53SMN1; SMN2DNM1HTT
SCHEMBL8569205 0.83 SLC22A1 (0.50) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL15538787 0.81 PSMD14 (0.51) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL15537740 0.81 PSMD14 (0.51) KCNH2SLC22A1TSHRHIF1AALDH1A1
SCHEMBL15538817 0.81 SLC22A1 (0.52) KCNH2SLC22A1TSHRHIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230003684-A1 IS-FET NITRATE SENSOR AND METHOD OF USE BREWER SCIENCE, INC. 2023-01-05 US claimed
WO-2023278882-A1 IS-FET NITRATE SENSOR AND METHOD OF USE BREWER SCIENCE, INC. (US) 2023-01-05 WO claimed
CN-114858885-A Electrochemical sensor for detecting carbon dioxide in liquid environment and preparation method thereof 重庆大学 2022-08-05 CN claimed
CN-111610241-B Fe for nondestructive micro-measurement3+Selective microelectrode and preparation method and application thereof 中国科学院烟台海岸带研究所 2022-06-21 CN claimed
US-11193915-B2 Composite material for the detection of chemical species INSTITUT NATIONAL D'OPTIQUE (CA) 2021-12-07 US claimed
US-20190017978-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2019-01-17 US claimed
US-10018584-B2 Optimized universal ion-selective electrode PION INC. (US) 2018-07-10 US claimed
US-9983162-B2 Method and device for detection of bioavailable drug concentration THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2018-05-29 US claimed
WO-2017088069-A1 COMPOSITE MATERIAL FOR THE DETECTION OF CHEMICAL SPECIES INSTITUT NATIONAL D'OPTIQUE (CA) 2017-06-01 WO claimed
US-20150119848-A1 METHOD AND DEVICE FOR DETECTION OF BIOAVAILABLE DRUG CONCENTRATION THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2015-04-30 US claimed
EP-2856133-A1 IMPROVED METHOD AND DEVICE FOR DETECTION OF BIOAVAILABLE DRUG CONCENTRATION The University of Tennessee Research Foundation (US) 2015-04-08 EP claimed
WO-2013180814-A1 IMPROVED METHOD AND DEVICE FOR DETECTION OF BIOAVAILABLE DRUG CONCENTRATION THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2013-12-05 WO claimed
US-20100012493-A1 MULTI-IONOPHORE MEMBRANE ELECTRODE MURPHY LINDY 2010-01-21 US claimed
EP-1565736-B1 MULTI-IONOPHORE MEMBRANE ELECTERODE DREW SCIENT CO LTD (US) 2007-01-24 EP claimed
US-6663756-B2 Capable of detecting two or moregas species on a single chip; quantitative analysis I-SENS INC. (KR) 2003-12-16 US claimed
US-20020070112-A1 Microchip-type oxygen gas sensor based on differential potentiometry I-SENS INC. (KR) 2002-06-13 US claimed
US-6143558-A CELLS CONTAINING AT LEAST ONE FIBERLESS OPTICAL SENSOR OF A SOLID PARTICLE FROM 1 MICROMETER TO 1 NANOMETER IN DIAMETER AND HAVING ONE OR MORE ACTIVE SENSOR MOLECULES IMBEDDED IN PARTICLE; NONTOXIC MONITORING AT SEVERAL LOCATIONS IN A CELL THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2000-11-07 US claimed
EP-3629928-B1 METHOD AND DEVICE FOR DETECTION OF BIOAVAILABLE DRUG CONCENTRATION IN A FLUID SAMPLE THE UNIV OF TENNESSEE RESEARCH FOUNDATION (US) 2025-11-05 EP disclosed
US-6379955-B1 Optical fiberless sensors REGENTS OF THE UNIVERSITY OF MICHIGAN 2002-04-30 US disclosed
EP-0667522-A2 Method of measuring ion concentration and apparatus therefor KABUSHIKI KAISHA TOSHIBA (JP) 1995-08-16 EP disclosed