Ether

Ether

SCHEMBL4279341

C=C(C)C(=O)OCC(C)C.CCOCC

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.81
THRB P10828 1/20 0.58
ALDH1A1 P00352 7/20 0.41
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GPR35 Q9HC97 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 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
SCHEMBL6560644 0.90 TSHR (0.84) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL24562 0.90 TSHR (1.00) TSHRTHRBALDH1A1SMN1; SMN2
SCHEMBL9082422 0.88 TSHR (0.95) TSHRTHRBALDH1A1SMN1; SMN2
Ethylene SCHEMBL27833189 0.88 TSHR (0.95) TSHRTHRBALDH1A1SMN1; SMN2
Hydroxyl Radical SCHEMBL28311885 0.88 TSHR (0.95) TSHRTHRBALDH1A1SMN1; SMN2
Ether SCHEMBL5840589 0.87 TSHR (0.60) TSHRTHRBALDH1A1LMNAHSD17B10
Ethylamine SCHEMBL11345820 0.86 TSHR (0.84) TSHRTHRBALDH1A1SMN1; SMN2GPR35
Methacrylic Acid SCHEMBL4581267 0.85 TSHR (0.75) TSHRTHRBALDH1A1SMN1; SMN2LMNA
SCHEMBL9645536 0.85 TSHR (0.75) TSHRTHRBALDH1A1SMN1; SMN2LMNA
SCHEMBL8978071 0.84 TSHR (0.88) TSHRTHRBALDH1A1SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2112710-A1 DYE-SENSITIZED SOLAR CELL Ngk Spark Plug Co., Ltd. (JP) 2009-10-28 EP disclosed
CN-100380730-C Dye-sensitized solar cell NGK SPARK PLUG CO (JP) 2008-04-09 CN disclosed
US-20070006917-A1 Dye-sensitized solar cell ROSETTA INPHARMATICS LLC 2007-01-11 US disclosed
CN-1809946-A Dye-sensitized solar cell NGK SPARK PLUG CO (JP) 2006-07-26 CN disclosed