SCHEMBL8516879

SCHEMBL8516879

C=C(C)C(=O)OCC.C=C(CC=CC(=O)O)C(=O)OCCO

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
TSHR P16473 5/20 0.39
HCAR2 Q8TDS4 2/20 0.36
ALDH1A1 P00352 3/20 0.34
GLO1 Q04760 1/20 0.32
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
MAPT P10636 1/20 0.30

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
1,1-Dichloroethene SCHEMBL5272297 0.96 THRB (0.40) THRBTSHRHCAR2ALDH1A1
SCHEMBL10940121 0.88 TSHR (0.51) THRBTSHRHCAR2ALDH1A1POLB
SCHEMBL17997322 0.88 ALDH1A1 (0.42) THRBTSHRALDH1A1
SCHEMBL916717 0.87 TSHR (0.38) TSHRHCAR2APEX1TDP1
Methacrylic Acid SCHEMBL4919048 0.86 HCAR2 (0.42) THRBTSHRHCAR2ALDH1A1GLO1
SCHEMBL2023097 0.85 HCAR2 (0.47) TSHRHCAR2ALDH1A1GLO1APEX1
Acrylic Acid Ethyl Ester SCHEMBL10579424 0.85 TSHR (0.46) THRBTSHRHCAR2ALDH1A1MAPT
Acrylic Acid Ethyl Ester SCHEMBL19409893 0.85 TSHR (0.38) THRBTSHRHCAR2ALDH1A1
SCHEMBL8678429 0.85 ALDH1A1 (0.44) THRBTSHRHCAR2ALDH1A1GLO1
SCHEMBL19410302 0.84 TSHR (0.42) THRBTSHRHCAR2ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5972557-A A SILVER HALIDE EMULSION LAYER, AN IMAGE RECEIVING LAYER AND ONE TEMPORARY BARRIER LAYER FORMED BY APPLYING AN ORGANIC SOLVENT CONTAINING TWO KINDS OF POLYMER WITH SPECIFIC GLASS TRANSITION TEMPERATURE AND CONTAINING HYDROXYALKYL ACRYLATES FUJI PHOTO FILM CO., LTD. (JP) 1999-10-26 US disclosed