SCHEMBL15744312

SCHEMBL15744312

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.34
RARA P10276 2/20 0.34
RARG P13631 1/20 0.34
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MCL1 Q07820 1/20 0.32
THRB P10828 1/20 0.31
KIF11 P52732 1/20 0.31
MAOB P27338 4/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 1/20 0.30
MAPT P10636 1/20 0.30
GFER P55789 1/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
SCHEMBL13002204 0.92 RARB (0.36) RARBRARARARGNPC1RAB9A
SCHEMBL15744320 0.92 S1PR1 (0.35) RARBRARARARGMCL1KIF11
SCHEMBL17108380 0.91 RARB (0.35) RARBRARARARGNPC1RAB9A
SCHEMBL503178 0.91 RARB (0.35) RARBRARARARGNPC1RAB9A
SCHEMBL15744313 0.90 RARB (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL16841956 0.90 RARB (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL15744500 0.90 RARB (0.34) RARBRARARARGNPC1RAB9A
SCHEMBL14226535 0.89 KIF11 (0.40) RARBRARARARGNPC1RAB9A
SCHEMBL15877162 0.89 MCL1 (0.36) RARBRARARARGNPC1RAB9A
SCHEMBL19393985 0.89 RARB (0.34) RARBRARARARGNPC1RAB9A

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