SCHEMBL15744353

SCHEMBL15744353

CCCc1ccc2cc(-c3cc(F)c(COc4cc(F)c(C(F)(F)OC(F)(F)F)c(F)c4)c(F)c3)ccc2c1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.32
FFAR1 O14842 2/20 0.32
PPARD Q03181 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
PKM P14618 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL15745117 0.96 FFAR1 (0.32) FFAR4FFAR1ESR1ESR2
SCHEMBL15744940 0.94 FFAR4 (0.32) FFAR4ESR1ESR2
SCHEMBL15744939 0.90 PPARD (0.35) FFAR1PPARDHRH3NPC1TP53
SCHEMBL15744846 0.90 PPARD (0.35) FFAR1PPARDHRH3NPC1TP53
SCHEMBL15744498 0.89 HRH3 (0.38) FFAR4ESR1ESR2HRH3NPC1
SCHEMBL15745088 0.88 HDAC1 (0.38) FFAR4FFAR1PPARDHRH3
SCHEMBL15744997 0.88 FFAR1 (0.32) FFAR1PPARDESR1ESR2HRH3
SCHEMBL15745105 0.87 HRH3 (0.33) FFAR4ESR1ESR2HRH3NPC1
SCHEMBL15744839 0.87 HRH3 (0.33) FFAR4ESR1ESR2HRH3NPC1
SCHEMBL15744503 0.85 ESR1 (0.34) FFAR4ESR1ESR2HRH3NPC1

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 5 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
EP-2735599-A1 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC Corporation (JP) 2014-05-28 EP disclosed