SCHEMBL13310792

SCHEMBL13310792

C=CC(=O)CCc1ccc(CCCc2ccc(Cc3ccc(CCC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.46
THRA P10827 6/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC1 Q13547 3/20 0.43
TRPV1 Q8NER1 1/20 0.41
GPR52 Q9Y2T5 1/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
TBXAS1 P24557 2/20 0.39
HDAC3 O15379 1/20 0.38
MAPK1 P28482 1/20 0.38
ADRA1A P35348 1/20 0.38
HDAC4 P56524 1/20 0.38
SLC6A3 Q01959 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38

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
SCHEMBL16812840 0.96 THRB (0.43) THRBTHRAMEN1KMT2AGPR52
SCHEMBL13310793 0.94 THRB (0.50) THRBTHRAMEN1KMT2AHDAC1
SCHEMBL17897411 0.84 FFAR1 (0.52) THRBTHRAGPR52BCHEACHE
SCHEMBL15272414 0.82 ESR1 (0.50) THRBMEN1KMT2ATRPV1MAPK1
SCHEMBL27538965 0.81 ALDH1A1 (0.42) THRBTHRAMEN1KMT2AGPR52
SCHEMBL22522189 0.81 FFAR1 (0.50) THRBTHRABCHEACHEFFAR1
SCHEMBL22522171 0.81 HDAC1 (0.49) MEN1KMT2AHDAC1HDAC3HDAC4
Hydrochloric Acid SCHEMBL27699853 0.81 ESR1 (0.48) THRBMEN1KMT2ATRPV1MAPK1
SCHEMBL4424144 0.80 GPR52 (0.59) KMT2AHDAC1TRPV1GPR52HDAC3
Hydrochloric Acid SCHEMBL27720366 0.78 GPR52 (0.58) KMT2AHDAC1TRPV1GPR52HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828548-B2 Liquid-crystal composition DIC CORPORATION (JP) 2017-11-28 US disclosed
US-9771517-B2 Liquid-crystal optical modulation element DIC CORPORATION (JP) 2017-09-26 US disclosed
US-20160194561-A1 DIFLUOROPHENYL LIQUID CRYSTAL COMPOSITION DIC CORPORATION (JP) 2016-07-07 US disclosed
US-20160017226-A1 LIQUID-CRYSTAL OPTICAL MODULATION ELEMENT DIC CORPORATION (JP) 2016-01-21 US disclosed
US-20150259600-A1 LIQUID-CRYSTAL COMPOSITION DIC CORPORATION (JP) 2015-09-17 US disclosed
US-20140327862-A1 FERROELECTRIC LIQUID CRYSTAL COMPOSITION AND FERROELECTRIC LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2014-11-06 US disclosed
US-20140313468-A1 LIQUID CRYSTAL DISPLAY ELEMENT DIC CORPORATION (JP) 2014-10-23 US disclosed
US-8405799-B2 Polymer-stabilized liquid crystal composition, liquid crystal display device, method for producing liquid crystal display device DIC CORPORATION (JP) 2013-03-26 US disclosed
US-20100149446-A1 POLYMER-STABILIZED LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR PRODUCING LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2010-06-17 US disclosed