SCHEMBL7563208

SCHEMBL7563208

CCCCOCCCCOC(F)(F)C(F)(F)C(F)(F)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.41
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
PLA2G2C Q5R387 1/20 0.35
TSHR P16473 2/20 0.35
CES1 P23141 3/20 0.35
MAPT P10636 2/20 0.33
HSD17B10 Q99714 1/20 0.33
FAAH O00519 4/20 0.33
MEN1 O00255 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL7560000 0.94 CES2 (0.35) CES2TSHRCES1HSD17B10FAAH
SCHEMBL9017271 0.84 CES2 (0.44) CES2CYP4F2CYP4A11PLA2G2CTSHR
SCHEMBL7261876 0.84 CES2 (0.37) CES2TSHRCES1HSD17B10FAAH
SCHEMBL7561382 0.81 CES2 (0.46) CES2PLA2G2CCES1HSD17B10FAAH
SCHEMBL7560983 0.81 CES2 (0.46) CES2PLA2G2CCES1HSD17B10FAAH
SCHEMBL7563633 0.81 CES2 (0.46) CES2PLA2G2CCES1HSD17B10FAAH
SCHEMBL7563945 0.76 CES1 (0.43) CES2CYP4F2CYP4A11PLA2G2CTSHR
SCHEMBL9139695 0.74 CES2 (0.42) CES2PLA2G2CTSHRCES1MAPT
SCHEMBL16263374 0.74 PLA2G2C (0.42) CES2CYP4F2CYP4A11PLA2G2CTSHR
SCHEMBL16263371 0.74 PLA2G2C (0.42) CES2CYP4F2CYP4A11PLA2G2CTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638112-B1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING & MFG (US) 2002-08-07 EP disclosed
EP-0792255-B1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING & MFG (US) 2001-02-28 EP disclosed
EP-0792255-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-03 EP disclosed
WO-1996015092-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-23 WO disclosed
EP-0638112-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-02-15 EP disclosed
WO-1993022396-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-11-11 WO disclosed