SCHEMBL15744310

SCHEMBL15744310

CCCc1ccc2c(F)c(-c3ccc(-c4cc(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 7)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 2/20 0.32
RARB P10826 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PDK2 Q15119 1/20 0.31
ALOX5 P09917 1/20 0.30
MPL P40238 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
SCHEMBL15744526 0.96 NCEH1 (0.34) NCEH1PDK2MPL
SCHEMBL15745069 0.94 ALOX5AP (0.33)
SCHEMBL15744908 0.91 ALOX5AP (0.31)
SCHEMBL3153489 0.89 ESR1 (0.33) NCEH1RARBESR1ESR2PDK2
SCHEMBL15744459 0.89 HDAC1 (0.34)
SCHEMBL15744998 0.87
SCHEMBL15745071 0.86
SCHEMBL15745204 0.86
SCHEMBL3166503 0.86 ALOX5AP (0.34) NCEH1RARBESR1ESR2PDK2
SCHEMBL3152086 0.85 ALOX5 (0.36) NCEH1RARBESR1ESR2ALOX5

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