SCHEMBL16248152

SCHEMBL16248152

CCOc1ccc(-c2ccc(OCC)c(F)c2F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.50
TDP1 Q9NUW8 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.44
FFAR4 Q5NUL3 2/20 0.43
FFAR1 O14842 1/20 0.43
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
LMNA P02545 2/20 0.42
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
LTA4H P09960 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL9563850 0.98 NQO1 (0.48) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL9492786 0.98 NQO1 (0.48) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL14766357 0.91 NQO1 (0.41) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL14767064 0.91 NQO1 (0.41) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL9563759 0.91 NQO1 (0.56) NQO1TDP1MAPTFFAR4FFAR1
SCHEMBL23619685 0.90 FFAR1 (0.45) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL11953532 0.90 ADORA3 (0.45) TDP1CYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL14766253 0.89 FFAR1 (0.41) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL14767163 0.89 FFAR1 (0.41) NQO1TDP1CYP1A2CYP2D6CYP2C19
SCHEMBL9563691 0.89 CYP2D6 (0.45) NQO1TDP1CYP1A2CYP2D6CYP2C19

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-20170327743-A1 LIQUID CRYSTAL DISPLAY DEVICE AND METHOD FOR MANUFACTURING SAME JNC CORP (JP) 2017-11-16 US disclosed
US-9771519-B2 Liquid crystal display device and method for manufacturing same JNC CORPORATION (JP) 2017-09-26 US disclosed
US-9234134-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-01-12 US disclosed
US-20150275089-A1 LIQUID CRYSTAL DISPLAY ELEMENT AND METHOD FOR MANUFACTURING SAME JNC PETROCHEMICAL CORPORATION (JP) 2015-10-01 US disclosed
US-20140339472-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2014-11-20 US disclosed