SCHEMBL17995563

SCHEMBL17995563

C=CC(=O)OCCCOc1ccc(C(=O)OCc2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(COC(=O)c5ccc(OCCCOC(=O)C=C)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.47
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ MAPT P10636 4/20 0.45
▸ TSHR P16473 2/20 0.44
▸ CYP2C9 P11712 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ ACR P10323 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41

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
SCHEMBL28399672 1.00 THRB (0.47) THRBKMT2AMEN1MAPTTSHR
SCHEMBL1500554 0.96 HTT (0.46) THRBKMT2AMEN1MAPTTSHR
SCHEMBL18499308 0.94 KMT2A (0.43) THRBKMT2AMEN1MAPTTSHR
SCHEMBL26691387 0.93 KMT2A (0.51) THRBKMT2AMEN1MAPTTSHR
SCHEMBL103247 0.91 THRB (0.55) THRBKMT2AMAPTTSHRCYP2C9
SCHEMBL11917945 0.91 THRB (0.55) THRBKMT2AMAPTTSHRCYP2C9
SCHEMBL16885070 0.91 THRB (0.55) THRBKMT2AMAPTTSHRCYP2C9
SCHEMBL18470122 0.91 THRB (0.55) THRBKMT2AMAPTTSHRCYP2C9
SCHEMBL17279043 0.90 HTT (0.47) THRBKMT2AMEN1MAPTTSHR
SCHEMBL12963215 0.90 HTT (0.47) THRBKMT2AMEN1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9567524-B2 Polymerizable liquid crystal compound, and compensation film, antireflective film, and display device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-02-14 — — US disclosed
US-9567524-B2 Polymerizable liquid crystal compound, and compensation film, antireflective film, and display device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-02-14 — — US disclosed
US-20160230090-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, AND COMPENSATION FILM, ANTIREFLECTIVE FILM, AND DISPLAY DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-11 — — US disclosed
US-20160230090-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, AND COMPENSATION FILM, ANTIREFLECTIVE FILM, AND DISPLAY DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-11 — — US disclosed
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