SCHEMBL9619137

SCHEMBL9619137

CCCC(CCC)C(C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.55
AKR1A1 P14550 1/20 0.55
CHRM3 P20309 1/20 0.55
HTR2A P28223 1/20 0.55
HTR2C P28335 1/20 0.55
ADRA1A P35348 1/20 0.55
HRH1 P35367 1/20 0.55
DRD3 P35462 1/20 0.55
SLC6A3 Q01959 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
NFKB1 P19838 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
GRIK1 P39086 1/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41

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
SCHEMBL27701799 0.91 CHRM1 (0.46) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL9619148 0.90 HDAC1 (0.50) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL7779103 0.87 GPR84 (0.55) GRIK1SLC1A2SLC1A1GRIK2CA2
SCHEMBL28364272 0.87 GPR84 (0.55) GRIK1SLC1A2SLC1A1GRIK2CA2
SCHEMBL7204731 0.87 GPR84 (0.55) GRIK1SLC1A2SLC1A1GRIK2CA2
SCHEMBL27922525 0.87 CHRM1 (0.43) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL5859578 0.84 CA2 (0.54) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL5354810 0.83 ACE2 (0.52) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL23833697 0.82 CHRM1 (0.43) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL3213683 0.80 GPR84 (0.59) GRIK1SLC1A2SLC1A1GRIK2CA2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3053935-B1 CATALYST COMPOSITION FOR OLEFIN POLYMERIZATION AND APPLICATION OF SAME CHINA PETROLEUM & CHEM CORP (CN) 2019-05-08 EP claimed
EP-3770234-B1 DEMULSIFIER FOR QUATERNARY AMMONIUM SALT CONTAINING FUELS AFTON CHEMICAL CORP (US) 2023-11-08 EP disclosed
US-11008526-B2 Demulsifier for quaternary ammonium salt containing fuels CRODA INC. (US) 2021-05-18 US disclosed
US-20210024844-A1 DEMULSIFIER FOR QUATERNARY AMMONIUM SALT CONTAINING FUELS CRODA INC. (US) 2021-01-28 US disclosed
EP-3770234-A1 DEMULSIFIER FOR QUATERNARY AMMONIUM SALT CONTAINING FUELS Afton Chemical Corporation (US) 2021-01-27 EP disclosed
EP-2987845-B1 Use of quaternary ammonium salts in gasoline fuel to improve performance AFTON CHEMICAL CORP (US) 2018-05-09 EP disclosed
US-9677020-B2 Hydrocarbyl soluble quaternary ammonium carboxylates and fuel compositions containing them AFTON CHEMICAL CORPORATION (US) 2017-06-13 US disclosed
EP-2987845-A1 Use of quaternary ammonium salts in gasoline fuel to improve performance Afton Chemical Corporation (US) 2016-02-24 EP disclosed
US-20150376524-A1 HYDROCARBYL SOLUBLE QUATERNARY AMMONIUM CARBOXYLATES AND FUEL COMPOSITIONS CONTAINING THEM AFTON CHEMICAL CORPORATION 2015-12-31 US disclosed
EP-2960319-A2 HYDROCARBYL SOLUBLE QUATERNARY AMMONIUM CARBOXYLATES AND FUEL COMPOSITIONS CONTAINING THEM Afton Chemical Corporation (US) 2015-12-30 EP disclosed
EP-0291074-B1 PROCESS FOR PRODUCING QUATERNARY SALTS MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1992-01-29 EP disclosed
EP-0246825-B1 QUATERNARY SALT SOLUTION ELECTROLYTE FOR ELECTROLYTIC CAPACITORS MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1991-02-27 EP disclosed
US-4892944-A Process for producing quaternary salts MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-01-09 US disclosed
EP-0291074-A2 Process for producing quaternary salts MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-11-17 EP disclosed
US-4774011-A Electrolyte for aluminum electrolytic capacitor MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-09-27 US disclosed
EP-0246825-A2 Quaternary salt solution electrolyte for electrolytic capacitors MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1987-11-25 EP disclosed