SCHEMBL6666424

SCHEMBL6666424

CC=CCCC1CCC(c2ccc(COC(F)(F)Cc3ccc(OC(F)(F)F)c(F)c3)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 6/20 0.33
HCRTR1 O43613 6/20 0.33
HCRTR2 O43614 6/20 0.33
PDE2A O00408 1/20 0.32
EPHX2 P34913 2/20 0.31
CHRM2 P08172 1/20 0.31

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
SCHEMBL6662069 0.90 FFAR4 (0.32)
SCHEMBL6662142 0.89 P2RX7 (0.34) P2RX7HCRTR1HCRTR2PDE2A
SCHEMBL6663137 0.88 CYP2C9 (0.39) P2RX7HCRTR1HCRTR2PDE2AEPHX2
SCHEMBL6666599 0.87 ESR2 (0.38)
SCHEMBL6661270 0.87 FFAR4 (0.32)
SCHEMBL6661269 0.86 CARM1 (0.35) EPHX2
SCHEMBL6662874 0.85 P2RX7 (0.34) P2RX7HCRTR1HCRTR2PDE2A
SCHEMBL6665401 0.85 SPHK1 (0.35) P2RX7HCRTR1HCRTR2PDE2A
SCHEMBL6666393 0.85 ESR2 (0.31)
SCHEMBL6667093 0.85 P2RX7 (0.35) P2RX7HCRTR1HCRTR2PDE2AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed