SCHEMBL15744608

SCHEMBL15744608

CCCc1ccc(-c2cc(F)c(C(F)(F)Oc3cc(F)c(OC(F)(F)F)c(F)c3)c(F)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.33
RARA P10276 1/20 0.33
RARG P13631 1/20 0.33
MAOB P27338 4/20 0.33
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MCL1 Q07820 1/20 0.31
GRM2 Q14416 1/20 0.31
SLC13A5 Q86YT5 1/20 0.31
CHRNA7 P36544 1/20 0.30
THRB P10828 1/20 0.30
KIF11 P52732 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
FFAR4 Q5NUL3 2/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 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
SCHEMBL20118150 0.92 GRM2 (0.36) RARBRARARARGMAOBMCL1
SCHEMBL7728916 0.90 FFAR4 (0.36) RARBRARACHRNA7KIF11PRMT6
SCHEMBL15744500 0.90 RARB (0.34) RARBRARARARGMAOBNPC1
SCHEMBL15744313 0.90 RARB (0.34) RARBRARARARGMAOBNPC1
SCHEMBL13002204 0.90 RARB (0.36) RARBRARARARGMAOBNPC1
SCHEMBL18719620 0.89 RXRA (0.35) RARBRARARARGMAOBNPC1
SCHEMBL17108380 0.89 RARB (0.35) RARBRARARARGMAOBNPC1
SCHEMBL503178 0.89 RARB (0.35) RARBRARARARGMAOBNPC1
SCHEMBL18310368 0.88 RARB (0.32) RARBRARARARGNPC1TP53
SCHEMBL19829163 0.88 RARB (0.32) RARBRARARARGNPC1TP53

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 6 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
EP-2735599-B1 Liquid crystal compound having CF2OCF3 at terminal, liquid crystal composition and liquid crystal display device JNC CORP (JP) 2015-04-29 EP 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