SCHEMBL6661270

SCHEMBL6661270

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

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.32
KDM1A O60341 1/20 0.32
ESR2 Q92731 1/20 0.30
RXRA P19793 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL6666393 0.89 ESR2 (0.31) FFAR4ESR2
SCHEMBL6666599 0.89 ESR2 (0.38) ESR2
SCHEMBL6666993 0.88 KDM1A (0.33) FFAR4KDM1AESR2RXRAGRIN1
SCHEMBL6666424 0.87 P2RX7 (0.33)
SCHEMBL6667625 0.87 CYP2C9 (0.41) ESR2
SCHEMBL6661331 0.86 AOC3 (0.34) FFAR4KDM1A
SCHEMBL6663508 0.86 IDO1 (0.40) ESR2
SCHEMBL6662069 0.85 FFAR4 (0.32) FFAR4ESR2
SCHEMBL6666051 0.85 RXRA (0.33) FFAR4KDM1ARXRAGRIN1GRIN2B
SCHEMBL6665088 0.85 FFAR1 (0.32)

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