SCHEMBL16153152

SCHEMBL16153152

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL11682529 0.83 TSHR (0.37) TSHRALDH1A1
SCHEMBL2740738 0.81 TSHR (0.45) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL12428762 0.81 TSHR (0.38) TSHR
SCHEMBL1887481 0.81 TSHR (0.38) TSHR
Ethane SCHEMBL1585650 0.79 TSHR (0.43) TSHRALDH1A1TP53CYP3A4MAPK1
Hydrochloric Acid SCHEMBL21955704 0.79 TSHR (0.37) TSHR
SCHEMBL16153154 0.79 TSHR (0.38) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL3339185 0.78 TSHR (0.36) TSHR
SCHEMBL6928978 0.78 TSHR (0.42) TSHRALDH1A1TP53CYP3A4MAPK1
SCHEMBL20626572 0.77 TSHR (0.45) TSHRALDH1A1TP53CYP3A4MAPK1

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
EP-2787564-A1 BINDER RESIN FOR NONAQUEOUS SECONDARY BATTERY ELECTRODE, BINDER RESIN COMPOSITION FOR NONAQUEOUS SECONDARY BATTERY ELECTRODE, SLURRY COMPOSITION FOR NONAQUEOUS SECONDARY BATTERY ELECTRODE, ELECTRODE FOR NONAQUEOUS SECONDARY BATTERY, AND NONAQUEOUS SECONDARY BATTERY Mitsubishi Rayon Co., Ltd. (JP) 2014-10-08 EP disclosed