SCHEMBL8600399

SCHEMBL8600399

CCCCCCCOCC(O)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.56
CES2 O00748 2/20 0.55
HTT P42858 2/20 0.55
PLA2G2C Q5R387 3/20 0.51
SPHK1 Q9NYA1 1/20 0.50
CES1 P23141 1/20 0.50
LPAR5 Q9H1C0 4/20 0.47
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.44
LPAR1 Q92633 5/20 0.44
LPAR3 Q9UBY5 5/20 0.44
LPAR2 Q9HBW0 4/20 0.44
LPAR6 P43657 3/20 0.44
LPAR4 Q99677 3/20 0.44

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
SCHEMBL8599113 1.00 USP2 (0.56) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8600393 1.00 USP2 (0.56) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8598749 1.00 USP2 (0.56) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8598288 1.00 USP2 (0.56) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8599077 0.98 USP2 (0.53) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8596436 0.92 USP2 (0.46) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL8597882 0.84 HSD17B10 (0.54) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL9847324 0.80 TSHR (0.39) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL9412145 0.80 CETP (0.34) USP2CES2HTTPLA2G2CSPHK1
SCHEMBL28692169 0.80 HSD17B10 (0.50) USP2CES2HTTPLA2G2CSPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0592669-B1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 1998-01-28 EP disclosed
US-5665270-A Optically active trifluorolactic acid derivative and liquid crystal composition CHISSO CORPORATION (JP) 1997-09-09 US disclosed
EP-0592669-A1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1994-04-20 EP disclosed
US-5204020-A For display elements or an electrooptical element SHOWA SHELL SEKIYU K.K. (JP) 1993-04-20 US disclosed
EP-0327349-A2 Liquid crystal compounds Showa Shell Sekiyu Kabushiki Kaisha (JP) 1989-08-09 EP disclosed