SCHEMBL11961785

SCHEMBL11961785

C=CC(=O)Oc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(OC(=O)C(=C)C)cc3)c(C)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.45
MAPT P10636 5/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
THRB P10828 2/20 0.40
KMT2A Q03164 8/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.37
GBA1 P04062 1/20 0.37
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL816216 0.93 ELANE (0.40) ELANEMAPTKDM4EPOLBMAPK1
SCHEMBL28986428 0.91 THRB (0.47) MAPTKDM4EPOLBMAPK1THRB
SCHEMBL816360 0.90 THRB (0.43) ELANEMAPTKDM4EPOLBMAPK1
SCHEMBL17433323 0.87 ELANE (0.56) ELANEMAPTKDM4ETHRBKMT2A
SCHEMBL22566517 0.87 ELANE (0.56) ELANEMAPTKDM4ETHRBKMT2A
SCHEMBL9906490 0.86 ELANE (0.45) ELANEMAPTKDM4EPOLBMAPK1
SCHEMBL12512895 0.86 THRB (0.43) MAPTKDM4EPOLBMAPK1THRB
SCHEMBL12733748 0.84 POLB (0.38) MAPTKDM4EPOLBMAPK1THRB
SCHEMBL815906 0.84 HGFAC (0.44) MAPTKDM4EPOLBMAPK1THRB
SCHEMBL22566554 0.83 ELANE (0.52) ELANEMAPTTHRBKMT2ALMNA

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-8663497-B2 Liquid crystal composition comprising polymerizable compound, and liquid crystal display element using said liquid crystal composition ADEKA CORPORATION (JP) 2014-03-04 US disclosed
US-8663497-B2 Liquid crystal composition comprising polymerizable compound, and liquid crystal display element using said liquid crystal composition ADEKA CORPORATION (JP) 2014-03-04 US disclosed
US-20120200794-A1 LIQUID CRYSTAL COMPOSITION COMPRISING POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAID LIQUID CRYSTAL COMPOSITION ADEKA CORPORATION (JP) 2012-08-09 US disclosed
US-20120200794-A1 LIQUID CRYSTAL COMPOSITION COMPRISING POLYMERIZABLE COMPOUND, AND LIQUID CRYSTAL DISPLAY ELEMENT USING SAID LIQUID CRYSTAL COMPOSITION ADEKA CORPORATION (JP) 2012-08-09 US disclosed