SCHEMBL7563633

SCHEMBL7563633

CCCCCCCCCCOC(F)(F)C(F)(F)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.46
EPHX1 P07099 3/20 0.41
FAAH O00519 7/20 0.39
CES1 P23141 6/20 0.39
NAAA Q02083 1/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PLA2G2C Q5R387 1/20 0.38

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
SCHEMBL7561382 1.00 CES2 (0.46) CES2EPHX1FAAHCES1NAAA
SCHEMBL7560983 1.00 CES2 (0.46) CES2EPHX1FAAHCES1NAAA
SCHEMBL7261876 0.93 CES2 (0.37) CES2EPHX1FAAHCES1MEN1
SCHEMBL7560000 0.83 CES2 (0.35) CES2EPHX1FAAHCES1MEN1
SCHEMBL7262111 0.82 CES2 (0.49) CES2EPHX1FAAHCES1NAAA
SCHEMBL16263371 0.82 PLA2G2C (0.42) CES2CES1HSD17B10PLA2G2C
SCHEMBL16263374 0.82 PLA2G2C (0.42) CES2CES1HSD17B10PLA2G2C
SCHEMBL7563208 0.81 CES2 (0.41) CES2FAAHCES1MEN1KMT2A
SCHEMBL7263038 0.74 CES2 (0.39) CES2FAAHCES1MEN1CYP1A2
SCHEMBL23502565 0.74 CES2 (0.46) CES2EPHX1FAAHCES1MEN1

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
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
WO-1996015092-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-23 WO disclosed
US-5482650-A Liquid crystal compounds having perfluoroether terminal portions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US disclosed
US-5437812-A Achiral and having low-temperature smectic mesophases or or latent smectic mesophases; used in mixtures with fluorinated liquid crystals; low birefringence and viscosity; high speed switches; stability MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-08-01 US 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