SCHEMBL14767280

SCHEMBL14767280

CCCCOc1ccc(-c2ccc(-c3ccc(OC(=O)c4ccc(OCC)cc4F)cc3)c(F)c2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.53
FFAR1 O14842 2/20 0.53
RARA P10276 1/20 0.50
RARB P10826 1/20 0.50
MCL1 Q07820 1/20 0.46
PTPN11 Q06124 2/20 0.45
CRBN Q96SW2 1/20 0.43
LMNA P02545 4/20 0.41
NPC1 O15118 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 1/20 0.41
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL14766965 0.97 RARA (0.53) FFAR4FFAR1RARARARBMCL1
SCHEMBL14766749 0.94 RARA (0.51) FFAR4FFAR1RARARARBMCL1
SCHEMBL14767124 0.94 FFAR4 (0.49) FFAR4FFAR1RARARARBLMNA
SCHEMBL14766401 0.94 FFAR4 (0.51) FFAR4FFAR1RARARARBMCL1
SCHEMBL12741985 0.91 RARA (0.47) FFAR4FFAR1RARARARBMCL1
SCHEMBL14766716 0.91 RARA (0.46) FFAR4FFAR1RARARARBMCL1
SCHEMBL14766424 0.90 RARA (0.48) FFAR4FFAR1RARARARBMCL1
SCHEMBL12741970 0.89 RARB (0.50) FFAR4FFAR1RARARARBPTPN11
SCHEMBL12741988 0.89 PTPN11 (0.48) FFAR4FFAR1RARARARBMCL1
SCHEMBL12741964 0.89 FFAR4 (0.44) FFAR4FFAR1RARARARBLMNA

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
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed