SCHEMBL15744999

SCHEMBL15744999

CCCc1ccc2c(F)c(-c3ccc(COc4cc(F)c(-c5ccc(C(F)(F)OC(F)(F)F)cc5)c(F)c4)c(F)c3)ccc2c1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33

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
SCHEMBL15744459 0.90 HDAC1 (0.34) HDAC1HDAC6HDAC5
SCHEMBL15744816 0.81
SCHEMBL15744908 0.81 ALOX5AP (0.31)
SCHEMBL6059389 0.79 MAOB (0.35)
SCHEMBL15744388 0.78 MPL (0.31)
SCHEMBL15744310 0.78 NCEH1 (0.32)
SCHEMBL15744568 0.78 HDAC1 (0.36) HDAC1HDAC6HDAC5
SCHEMBL6059671 0.78 PTGDR2 (0.35)
SCHEMBL15745088 0.77 HDAC1 (0.38) HDAC1HDAC6HDAC5
SCHEMBL15745202 0.77

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