SCHEMBL15588794

SCHEMBL15588794

Cc1ccc(OCc2ccc(F)cc2)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.56
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
STAT3 P40763 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
BRD4 O60885 1/20 0.48
PTGER1 P34995 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK14 Q16539 4/20 0.46
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.45
MAOB P27338 2/20 0.45
HTR1A P08908 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
FFAR4 Q5NUL3 3/20 0.44

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
SCHEMBL26434787 0.93 MRGPRX4 (0.58) MRGPRX4LMNAPOLBMAPTSTAT3
SCHEMBL22381399 0.88 BRD4 (0.52) MRGPRX4LMNAPOLBMAPTSTAT3
SCHEMBL16210864 0.87 MRGPRX4 (0.53) MRGPRX4LMNAMAPTHTTSMN1; SMN2
SCHEMBL171841 0.86 MRGPRX4 (0.68) MRGPRX4MAPTSTAT3HTTSMN1; SMN2
SCHEMBL17858626 0.83 MRGPRX4 (0.53) MRGPRX4LMNAPOLBMAPTSTAT3
SCHEMBL19242940 0.83 ACHE (0.53) LMNAPOLBMAPTSMN1; SMN2BRD4
SCHEMBL257777 0.83 MRGPRX4 (0.57) MRGPRX4LMNAHTTPTGER1FFAR4
SCHEMBL19374625 0.83 MRGPRX4 (0.50) MRGPRX4POLBMAPTMAPK14ALDH1A1
SCHEMBL16210297 0.83 MRGPRX4 (0.53) MRGPRX4LMNAMAPTHTTPTGER1
SCHEMBL26698908 0.83 MRGPRX4 (0.56) MRGPRX4LMNAMAPTHTTBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2855627-B1 BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA MERCK PATENT GMBH (DE) 2017-09-20 EP disclosed
US-20150175886-A1 MESOGENIC MEDIA AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2015-06-25 US disclosed
WO-2013174481-A1 MESOGENIC MEDIA AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2013-11-28 WO disclosed