SCHEMBL12375046

SCHEMBL12375046

C=C(C)C(=O)Cc1ccc(-c2ccc3cc(CCC(=O)Oc4ccc(COC(=O)C(=C)C)cc4)ccc3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAOA P21397 1/20 0.38
SLC6A2 P23975 1/20 0.38
RAB9A P51151 1/20 0.38
SLC6A3 Q01959 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 3/20 0.38
FFAR4 Q5NUL3 3/20 0.37
ENPP2 Q13822 1/20 0.36
CASP1 P29466 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
FFAR1 O14842 2/20 0.32
ASAH1 Q13510 1/20 0.32

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
SCHEMBL12375045 0.93 MAPT (0.41) MAPTKDM4ENPC1LMNATP53
SCHEMBL12375027 0.92 KMT2A (0.43) MAPTLMNAKMT2AFFAR1ASAH1
SCHEMBL12375053 0.86 THRB (0.43) MAPTKDM4ENPC1LMNATP53
SCHEMBL12375023 0.82 THRB (0.44) MAPTLMNAKMT2AFFAR1ASAH1
SCHEMBL12375060 0.82 KMT2A (0.46) MAPTKDM4ENPC1LMNACYP1A2
SCHEMBL12375057 0.82 THRB (0.44) MAPTLMNAKMT2AFFAR1ASAH1
SCHEMBL12375048 0.82 MAPT (0.37) MAPTKDM4ENPC1LMNATP53
SCHEMBL13963242 0.80 AKR1B10 (0.38) MAPTKDM4ELMNAMAOAKMT2A
SCHEMBL12375035 0.79 THRB (0.47) MAPTLMNAKMT2AFFAR1ALDH1A1
SCHEMBL17719443 0.79 KMT2A (0.46) MAPTKDM4ENPC1LMNATP53

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-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed