SCHEMBL18328875

SCHEMBL18328875

C=CC(=O)OCCCCCCOc1ccc(C(=O)OC2CCC(CCCCCC)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.43
PLA2G4B P0C869 1/20 0.43
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
RARB P10826 3/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
GPR119 Q8TDV5 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL14255568 1.00 TSHR (0.44) TSHRTP53HPGDPLA2G4BTHRA
SCHEMBL12567819 0.97 TSHR (0.41) TSHRTP53HPGDPLA2G4BTHRA
SCHEMBL16425378 0.96 TSHR (0.41) TSHRTP53HPGDPLA2G4BTHRA
SCHEMBL14907459 0.94 TSHR (0.41) TSHRTP53HPGDPLA2G4BTHRA
SCHEMBL12284999 0.94 PTPN2 (0.45) TSHRTP53HPGDPLA2G4BTHRB
SCHEMBL10534921 0.92 THRB (0.42) TSHRTP53HPGDTHRATHRB
SCHEMBL12087289 0.91 PTPN2 (0.43) TSHRTP53HPGDTHRATHRB
SCHEMBL19844216 0.91 PTPN2 (0.44) TSHRHPGDTHRBPTPN2PTPN1
SCHEMBL20222877 0.91 TSHR (0.46) TSHRTP53HPGDPLA2G4BTHRA
SCHEMBL16425384 0.90 PTPN2 (0.41) TSHRHPGDTHRBPTPN2PTPN1

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 7 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-9994772-B2 Liquid crystal display device DIC CORPORATION (JP) 2018-06-12 US disclosed
US-20170190972-A1 LIQUID CRYSTAL DISPLAY DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2017-07-06 US disclosed
US-20170190972-A1 LIQUID CRYSTAL DISPLAY DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2017-07-06 US disclosed
EP-3112930-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC Corporation (JP) 2017-01-04 EP disclosed
US-20160370626-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-12-22 US disclosed
US-20160370626-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-12-22 US disclosed