SCHEMBL14779809

SCHEMBL14779809

CCCCC(CC)OS(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA2 P00918 4/20 0.35
CA1 P00915 2/20 0.35
CTSK P43235 1/20 0.35
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.33
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
ATM Q13315 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
SCHEMBL6162071 0.94 TP53 (0.39) ALDH1A1CA2CA1TP53
SCHEMBL7352723 0.92 TP53 (0.38) CA2CA1TP53
SCHEMBL28870861 0.92 TP53 (0.38) CA2CA1TP53
SCHEMBL15125809 0.86 ALDH1A1 (0.40) ALDH1A1PRKCAPRKCDCA2CA1
SCHEMBL13636610 0.86 ALDH1A1 (0.40) ALDH1A1PRKCAPRKCDCA2CA1
SCHEMBL4662102 0.86 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL6307966 0.84 TP53 (0.42) ALDH1A1CA2CA1TP53
SCHEMBL16769160 0.83 ALDH1A1 (0.34) ALDH1A1PRKCAPRKCD
SCHEMBL15211949 0.83 TP53 (0.41) CA2CA1TP53
SCHEMBL3488909 0.83 TP53 (0.41) CA2CA1TP53

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
US-9240614-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2016-01-19 US disclosed
EP-2579377-B1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES (JP) 2014-09-03 EP disclosed
EP-2579377-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2013-04-10 EP disclosed
US-20130071733-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2013-03-21 US disclosed