SCHEMBL13586554

SCHEMBL13586554

CCOc1ccc(-c2ccc(OCc3ccc(-c4ccc(OC)cc4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
HTT P42858 1/20 0.39
GYS1 P13807 3/20 0.39
SYK P43405 4/20 0.39
FFAR1 O14842 2/20 0.39
FFAR4 Q5NUL3 2/20 0.39
ADORA3 P0DMS8 1/20 0.39
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.36

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
SCHEMBL12823203 1.00 LMNA (0.39) LMNAHTTGYS1SYKFFAR1
SCHEMBL10303168 0.95 GYS1 (0.39) LMNAGYS1SYKFFAR1FFAR4
SCHEMBL14766253 0.93 FFAR1 (0.41) LMNAGYS1FFAR1FFAR4MAPT
SCHEMBL14767163 0.93 FFAR1 (0.41) LMNAGYS1FFAR1FFAR4MAPT
SCHEMBL12823140 0.92 SYK (0.43) GYS1SYKFFAR1FFAR4MAPT
SCHEMBL12718978 0.92 SYK (0.43) GYS1SYKFFAR1FFAR4MAPT
SCHEMBL10302498 0.91 FFAR1 (0.39) GYS1FFAR1FFAR4ALDH1A1L3MBTL1
SCHEMBL12823271 0.91 FFAR1 (0.43) LMNAHTTGYS1SYKFFAR1
SCHEMBL12740490 0.90 FFAR1 (0.43) HTTGYS1FFAR1FFAR4ADORA3
SCHEMBL12737020 0.90 FFAR1 (0.43) HTTGYS1FFAR1FFAR4ADORA3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 WO disclosed