SCHEMBL27708474

SCHEMBL27708474

C=CC(=O)OC(C)(CC)C(=O)CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.36
TSHR P16473 2/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL28093702 0.82 THRB (0.40) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL27856676 0.74 THRB (0.42) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL7558348 0.73 TSHR (0.40) THRBTSHRHPGDHSD17B10ALDH1A1
Propionic Acid SCHEMBL5997033 0.72 FFAR3 (0.42) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL7166529 0.71 HSD17B10 (0.34) THRBTSHRHPGDALOX15HSD17B10
Ammonia Solution, Strong SCHEMBL28082914 0.71 TSHR (0.39) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL25044806 0.71 THRB (0.38) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL302801 0.71 THRB (0.43) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL1108008 0.71 TSHR (0.43) THRBTSHRHPGDHSD17B10ALDH1A1
SCHEMBL28853858 0.71 TSHR (0.35) THRBTSHRHPGDHSD17B10ALDH1A1

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
CN-101223181-A Adhesive compositions containing cyclosiloxane DESIGNER MOLECULES INC (US) 2008-07-16 CN disclosed