SCHEMBL701554

SCHEMBL701554

CC(=O)C(C)C(=O)O.CC(=O)C(C)C(=O)O.[SnH2]

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
FFAR3 O14843 1/20 0.38
LCK P06239 1/20 0.38
FYN P06241 1/20 0.38
SLC7A5 Q01650 2/20 0.36
ALDH1A1 P00352 2/20 0.32
GABRR1 P24046 2/20 0.32
RNPEP Q9H4A4 1/20 0.32
CYP1A2 P05177 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 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
SCHEMBL5386710 0.97
SCHEMBL79779 0.97
SCHEMBL10959727 0.93
SCHEMBL15654871 0.93
SCHEMBL125101 0.93 TP53 (0.44) TP53FFAR3LCKFYNSLC7A5
SCHEMBL23467150 0.93 TP53 (0.44) TP53FFAR3LCKFYNSLC7A5
Ammonia Solution, Strong SCHEMBL14935486 0.93
SCHEMBL10956052 0.93
SCHEMBL7133114 0.93
SCHEMBL6920808 0.93

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
US-8124273-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2012-02-28 US disclosed
US-20090280404-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES LTD (JP) 2009-11-12 US disclosed