SCHEMBL15744793

SCHEMBL15744793

CCCc1ccc(-c2ccc(C(F)(F)Oc3cc(F)c(C(F)(F)OC(F)(F)F)c(F)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.35
RARB P10826 2/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
PKM P14618 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MCL1 Q07820 1/20 0.32
SERPINE1 P05121 1/20 0.31
THRB P10828 1/20 0.31
ACACB O00763 1/20 0.30
ACACA Q13085 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
SCHEMBL15744915 0.98 MAOB (0.34) MAOBRARBRARARARGNPC1
SCHEMBL15745194 0.94 MAOB (0.32) MAOBRARBRARARARG
SCHEMBL15744360 0.93 MAOB (0.34) MAOBRARBRARARARGNPC1
SCHEMBL15745182 0.92 KIF11 (0.32) MAOB
SCHEMBL15744957 0.92 KIF11 (0.32) MAOB
SCHEMBL15745164 0.92 HRH3 (0.34) SERPINE1
SCHEMBL15744364 0.92
SCHEMBL15744500 0.91 RARB (0.34) MAOBRARBRARARARGNPC1
SCHEMBL15744313 0.91 RARB (0.34) MAOBRARBRARARARGNPC1
SCHEMBL15744836 0.91 HRH3 (0.33) SERPINE1

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