SCHEMBL8208520

SCHEMBL8208520

CCCC1CCC(c2ccc(-c3ccc(CCCCC4CCC(COC)CC4)cc3)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
RARB P10826 1/20 0.32
SPHK1 Q9NYA1 3/20 0.31
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 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
SCHEMBL8208566 1.00 FFAR4 (0.33) FFAR4HRH3RARBSPHK1ALOX5AP
SCHEMBL8215745 0.96 RARB (0.36) FFAR4RARBSPHK1
SCHEMBL8216052 0.93 ALOX5AP (0.32) FFAR4ALOX5APFEN1
SCHEMBL8216667 0.93 ALOX5AP (0.32) FFAR4ALOX5APFEN1
SCHEMBL8215972 0.92 GAA (0.32) FFAR4RARBSPHK1ALOX5APFEN1
SCHEMBL8216560 0.86 CYP2C9 (0.41) ALOX5APFEN1
SCHEMBL8220331 0.86 CYP2C9 (0.41) ALOX5APFEN1
SCHEMBL8215782 0.85 RARB (0.35) FFAR4HRH3RARBSPHK1
SCHEMBL8219104 0.85 RARB (0.35) FFAR4HRH3RARBSPHK1
SCHEMBL15581191 0.84 RARB (0.32) FFAR4RARBALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6117361-A FOUR RING COMPOUND HAVING AN ALKYL GROUP SUBSTITUTED WITH ONE OR MORE ETHERS, AND A HALOGEN ATOM SUBSTITUTED BENZENE RING; BROAD TEMPERATURE RANGE OF NEMATIC PHASE, HIGHER MISCIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS, AND CHEMICAL STABILITY CHISSO CORP. (JP) 2000-09-12 US disclosed
EP-0891961-A1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED 1,4-PHENYLENE SKELETONS, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 1999-01-20 EP disclosed