SCHEMBL15722947

SCHEMBL15722947

C/C=C/Oc1ccc(-c2ccc(OCC)cc2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.40
TDP1 Q9NUW8 3/20 0.38
MAPT P10636 2/20 0.38
FFAR4 Q5NUL3 2/20 0.37
FFAR1 O14842 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 2/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 2/20 0.36
TSHR P16473 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RELA Q04206 1/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL15722948 0.91 CYP2D6 (0.40) TDP1FFAR4FFAR1KDM4ENPC1
SCHEMBL15682079 0.85 PTGS2 (0.36) LMNAKDM4ENPC1ALDH1A1RAB9A
SCHEMBL15722941 0.84 PTGDR2 (0.32) LMNA
SCHEMBL15722967 0.83 FGFR2 (0.34) TDP1MAPTKDM4EALDH1A1CYP1A2
SCHEMBL16248152 0.83 NQO1 (0.50) NQO1TDP1MAPTFFAR4FFAR1
SCHEMBL15726854 0.82 FFAR1 (0.40) MAPTFFAR4FFAR1NPC1ALDH1A1
SCHEMBL15722940 0.82 PTGS2 (0.33)
SCHEMBL15722912 0.82 MPL (0.33) FFAR4
SCHEMBL9492786 0.82 NQO1 (0.48) NQO1TDP1MAPTFFAR4FFAR1
SCHEMBL9563850 0.82 NQO1 (0.48) NQO1TDP1MAPTFFAR4FFAR1

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-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193907-B2 Liquid crystal compound having vinyloxy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed
US-20140138582-A1 LIQUID CRYSTAL COMPOUND HAVING VINYLOXY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-05-22 US disclosed