SCHEMBL15744985

SCHEMBL15744985

CCCc1ccc(COc2cc(F)c(C(F)(F)OC(F)(F)F)c(F)c2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC5 Q9UQL6 2/20 0.34
FFAR1 O14842 3/20 0.33
HDAC8 Q9BY41 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
S1PR1 P21453 1/20 0.31
GPR119 Q8TDV5 3/20 0.31
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
IDO1 P14902 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
SCHEMBL15745088 0.89 HDAC1 (0.38) MAOBHDAC1HDAC6HDAC5FFAR1
SCHEMBL15744305 0.87 SENP8 (0.41) MAOBSENP8SENP7SENP6
SCHEMBL15744913 0.85 FFAR4 (0.33) HDAC1HDAC6HDAC5FFAR4
SCHEMBL15744530 0.84 S1PR1 (0.35) S1PR1
SCHEMBL15744459 0.83 HDAC1 (0.34) HDAC1HDAC6HDAC5
SCHEMBL15744568 0.83 HDAC1 (0.36) MAOBHDAC1HDAC6HDAC5FFAR1
SCHEMBL15744939 0.81 PPARD (0.35) MAOBFFAR1SENP8SENP7SENP6
SCHEMBL15744846 0.81 PPARD (0.35) MAOBFFAR1SENP8SENP7SENP6
SCHEMBL15744344 0.81 SENP8 (0.37) MAOBFFAR1SENP8SENP7SENP6
SCHEMBL15744408 0.80 THRB (0.34) FFAR4S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
US-9365774-B2 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-06-14 US disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed
US-20140145113-A1 LIQUID CRYSTAL COMPOUND HAVING CF2OCF3 AT TERMINAL, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-29 US disclosed