SCHEMBL10476502

SCHEMBL10476502

C#CCOC(=O)CCC(=O)OCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 3/20 0.40
TAAR1 Q96RJ0 1/20 0.40
TSHR P16473 5/20 0.38
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
CNR1 P21554 2/20 0.35
NPC1 O15118 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
EPHX2 P34913 2/20 0.34
CNR2 P34972 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL10010766 0.93 GSTP1 (0.51) GSTP1L3MBTL1ALDH1A1TSHRMAPT
SCHEMBL10009914 0.93 L3MBTL1 (0.50) GSTP1L3MBTL1ALDH1A1TAAR1TSHR
SCHEMBL334176 0.83 TSHR (0.50) L3MBTL1ALDH1A1TSHRMAPTPOLB
SCHEMBL4446043 0.83 GSTP1 (0.53) GSTP1L3MBTL1ALDH1A1TAAR1TSHR
SCHEMBL13496823 0.82 GSTP1 (0.44) GSTP1L3MBTL1ALDH1A1TAAR1TSHR
SCHEMBL16944212 0.82 CNR1 (0.41) L3MBTL1ALDH1A1TSHRMAPTPOLB
SCHEMBL30529014 0.81 TSHR (0.48) L3MBTL1ALDH1A1TSHRMAPTPOLB
SCHEMBL27561555 0.81 TSHR (0.48) L3MBTL1ALDH1A1TSHRMAPTPOLB
SCHEMBL10012842 0.81 LMNA (0.44) GSTP1L3MBTL1ALDH1A1TAAR1TSHR
SCHEMBL27101910 0.79 TSHR (0.43) L3MBTL1ALDH1A1TSHRMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2908376-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2015-08-19 EP disclosed
EP-2479831-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-07-25 EP disclosed