SCHEMBL18328845

SCHEMBL18328845

C=CC(=O)OCOc1ccc(COc2ccc(CCOC(=O)c3ccc(OCOC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 2/20 0.51
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
THRB P10828 2/20 0.44
PARP10 Q53GL7 1/20 0.43
RXRA P19793 3/20 0.43
RXRB P28702 3/20 0.43
PTPRC P08575 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TYR P14679 1/20 0.41
NR4A2 P43354 3/20 0.40
POLB P06746 1/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 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
SCHEMBL15582433 0.91 MAPT (0.49) NPC1RAB9ASMN1; SMN2MAPTESR1
SCHEMBL15582412 0.90 MAPT (0.48) NPC1RAB9ASMN1; SMN2MAPTESR1
SCHEMBL24555368 0.89 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MAPTESR1
SCHEMBL12733797 0.86 THRB (0.48) NPC1RAB9ASMN1; SMN2MAPTESR1
SCHEMBL19930199 0.86 PARP10 (0.47) NPC1RAB9ASMN1; SMN2MAPTTHRB
SCHEMBL19930200 0.86 PARP10 (0.47) NPC1RAB9ASMN1; SMN2MAPTTHRB
SCHEMBL19930196 0.86 PARP10 (0.47) NPC1RAB9ASMN1; SMN2MAPTTHRB
SCHEMBL19930202 0.86 PARP10 (0.47) NPC1RAB9ASMN1; SMN2MAPTTHRB
SCHEMBL102867 0.84 NPC1 (0.54) NPC1RAB9ASMN1; SMN2MAPTESR1
SCHEMBL18328857 0.83 THRB (0.43) NPC1RAB9ASMN1; SMN2MAPTESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9994772-B2 Liquid crystal display device DIC CORPORATION (JP) 2018-06-12 US disclosed
US-20180037680-A1 LAYERED BODY AND OPTICAL FILM OR LIQUID CRYSTAL ALIGNMENT FILM USING SAME DIC CORPORATION (JP) 2018-02-08 US disclosed
US-20170190972-A1 LIQUID CRYSTAL DISPLAY DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2017-07-06 US disclosed
US-20170073581-A1 MIXTURE THAT INCLUDES COMPOUND CONTAINING MESOGENIC GROUP DIC CORPORATION (JP) 2017-03-16 US disclosed
US-20170066967-A1 POLYMERIZABLE COMPOSITION COMPRISING COMPOUND HAVING MESOGENIC GROUP, AND POLYMER THEREOF DIC CORPORATION (JP) 2017-03-09 US disclosed
US-20160370626-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-12-22 US disclosed