SCHEMBL12375056

SCHEMBL12375056

C=CC(=O)Cc1ccc(-c2ccc(CCOC(=O)c3ccc(COC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.45
ESR2 Q92731 1/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TYR P14679 1/20 0.40
THRB P10828 4/20 0.36
LMNA P02545 2/20 0.36
SLC6A2 P23975 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
SLC6A3 Q01959 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
MET P08581 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 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
SCHEMBL12242814 0.86 MAPT (0.50) ESR1ESR2NPC1RAB9ASMN1; SMN2
SCHEMBL15582432 0.81 MAPT (0.53) ESR1ESR2NPC1RAB9ASMN1; SMN2
SCHEMBL17754280 0.80 MAPT (0.51) ESR1ESR2NPC1RAB9ASMN1; SMN2
SCHEMBL17577187 0.79 TSHR (0.52) TYRTHRBLMNACA12CA1
SCHEMBL12242502 0.79 FFAR1 (0.39) NPC1RAB9ATHRBLMNAL3MBTL1
SCHEMBL12375061 0.79 MAPT (0.46) ESR1ESR2NPC1RAB9ASMN1; SMN2
SCHEMBL15582433 0.78 MAPT (0.49) ESR1ESR2NPC1RAB9ASMN1; SMN2
SCHEMBL12375025 0.78 THRB (0.45) MAPTKMT2ATHRBLMNAALDH1A1
SCHEMBL12032270 0.77 TSHR (0.53) THRBCA12CA1METCA4
SCHEMBL12367978 0.77 HCAR2 (0.46) NPC1RAB9ASMN1; SMN2KMT2AMEN1

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