SCHEMBL6531007

SCHEMBL6531007

CCCCCOCC(C)OCC(C)OCC(C)OC(C)=O

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
PLA2G2C Q5R387 4/20 0.44
CES2 O00748 1/20 0.43
ADRA1D P25100 1/20 0.42
PTAFR P25105 1/20 0.42
HTR1D P28221 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1B P35368 1/20 0.42
DRD3 P35462 1/20 0.42
TMEM97 Q5BJF2 1/20 0.42
USP2 O75604 1/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR3 Q9UBY5 2/20 0.41
SPHK1 Q9NYA1 1/20 0.41
HTT P42858 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
TLR2 O60603 1/20 0.39

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
SCHEMBL19064961 1.00 TDP1 (0.46) TDP1PLA2G2CCES2ADRA1DPTAFR
SCHEMBL896773 0.98 PLA2G2C (0.47) TDP1PLA2G2CCES2ADRA1DPTAFR
SCHEMBL896910 0.98 PLA2G2C (0.47) TDP1PLA2G2CCES2ADRA1DPTAFR
SCHEMBL487272 0.95 TDP1 (0.47) TDP1PLA2G2CCES2ADRA1DPTAFR
SCHEMBL895988 0.95 TDP1 (0.47) TDP1PLA2G2CCES2ADRA1DPTAFR
SCHEMBL2230535 0.93 PLA2G2C (0.49) PLA2G2CCES2ADRA1DPTAFRHTR1D
SCHEMBL466059 0.92 CES2 (0.52) PLA2G2CCES2ADRA1DPTAFRHTR1D
SCHEMBL896030 0.92 CES2 (0.52) PLA2G2CCES2ADRA1DPTAFRHTR1D
SCHEMBL6881438 0.92 CES2 (0.52) PLA2G2CCES2ADRA1DPTAFRHTR1D
SCHEMBL896812 0.88 TDP1 (0.59) TDP1PLA2G2CADRA1DPTAFRHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759989-B2 Temperature-stable paraffin inhibitor compositions ECOLAB USA INC. (US) 2020-09-01 US disclosed
EP-3400369-A1 TEMPERATURE-STABLE PARAFFIN INHIBITOR COMPOSITIONS Ecolab Usa Inc. (US) 2018-11-14 EP disclosed
WO-2017120286-A1 TEMPERATURE-STABLE PARAFFIN INHIBITOR COMPOSITIONS ECOLAB USA INC. (US) 2017-07-13 WO disclosed
US-20170190949-A1 TEMPERATURE-STABLE PARAFFIN INHIBITOR COMPOSITIONS NORRISEAL-WELLMARK, INC. 2017-07-06 US disclosed
CN-1670628-B Resist composition DAICEL CHEM 2011-02-09 CN disclosed
JP-2005301210-A RESIST COMPOSITION DAICEL CHEM IND LTD 2005-10-27 JP disclosed
CN-1670628-A Resist composition DAICEL CHEM (JP) 2005-09-21 CN disclosed