SCHEMBL7620848

SCHEMBL7620848

C=CC(=O)OCCCCOc1ccc(OC(=O)c2ccc(OCCCCOC(=O)C=C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.55
ALDH1A1 P00352 3/20 0.51
CYP3A4 P08684 2/20 0.51
TSHR P16473 2/20 0.51
HTT P42858 3/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PRSS1 P07477 1/20 0.48
ACR P10323 1/20 0.48
HPGD P15428 2/20 0.47
MAPT P10636 5/20 0.47
KMT2A Q03164 3/20 0.47

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
SCHEMBL16674157 1.00 THRB (0.55) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL12794252 1.00 THRB (0.55) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL450098 1.00 THRB (0.55) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL14346695 1.00 THRB (0.55) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL13220816 1.00 THRB (0.55) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL25138377 0.99 ALDH1A1 (0.54) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL20706567 0.99 THRB (0.54) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL12592433 0.99 ALDH1A1 (0.54) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL22138760 0.99 ALDH1A1 (0.54) THRBALDH1A1CYP3A4TSHRHTT
SCHEMBL22138759 0.99 ALDH1A1 (0.54) THRBALDH1A1CYP3A4TSHRHTT

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-20210108142-A1 POLARIZED LUMINESCENT FILM DIC CORPORATION (JP) 2021-04-15 US disclosed
US-20200264461-A1 LIGHT CONVERSION FILM AND IMAGE DISPLAY DEVICE DIC CORPORATION (JP) 2020-08-20 US disclosed
US-20200199452-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, OPTICAL FILM INCLUDING THE SAME, AND METHOD FOR PRODUCING OPTICAL FILM DIC CORPORATION (JP) 2020-06-25 US disclosed
US-6440328-B1 ONE STEP ESTERIFICATION OF HYDROQUINONE BIS(HYDROXYBENZOATE) WITH 4-CHLOROBUTYL 3-CHLOROPROPIONATE AND ELIMINATION OF HCL CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2002-08-27 US disclosed
EP-1059282-B1 Preparation of acrylated liquid crystal compounds CONSORTIUM ELEKTROCHEM IND (DE) 2001-11-07 EP disclosed
EP-1059282-A1 Preparation of acrylated liquid crystal compounds Consortium für elektrochemische Industrie GmbH (DE) 2000-12-13 EP disclosed