SCHEMBL14767183

SCHEMBL14767183

C=CCCOc1ccc(OC(=O)C2CCC(c3ccc(-c4ccc(OCC)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.36
PPARD Q03181 5/20 0.36
FFAR4 Q5NUL3 7/20 0.35
HPGD P15428 1/20 0.33
CAMKK1 Q8N5S9 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
JAK1 P23458 1/20 0.32
SCN9A Q15858 1/20 0.31
USP2 O75604 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 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
SCHEMBL14767130 0.94 SCN9A (0.36) FFAR1PPARDFFAR4SCN9A
SCHEMBL14766819 0.94 FFAR1 (0.38) FFAR1PPARDFFAR4HPGDCAMKK1
SCHEMBL14767293 0.93 FFAR4 (0.35) FFAR1PPARDFFAR4SCN9A
SCHEMBL12742383 0.93 FFAR1 (0.33) FFAR1PPARDFFAR4
SCHEMBL14767088 0.92 FFAR1 (0.37) FFAR1PPARDFFAR4HPGDCAMKK1
SCHEMBL14767250 0.92 HPGD (0.35) FFAR1PPARDFFAR4HPGDJAK1
SCHEMBL14766194 0.92 HPGD (0.35) FFAR1PPARDFFAR4HPGDJAK1
SCHEMBL14767085 0.91 FFAR1 (0.41) FFAR1PPARDFFAR4HPGDCAMKK1
SCHEMBL12742388 0.90 FFAR4 (0.33) FFAR1PPARDFFAR4TSHR
SCHEMBL12823928 0.90 FFAR4 (0.33) FFAR4

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