SCHEMBL14778331

SCHEMBL14778331

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

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
TSHR P16473 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA2 P00918 6/20 0.35
CA1 P00915 4/20 0.35
CTSK P43235 1/20 0.35
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.33
TP53 P04637 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 2/20 0.32
ATM Q13315 1/20 0.32
FDPS P14324 1/20 0.31
DNM1 Q05193 1/20 0.31

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
SCHEMBL14779605 0.92 TP53 (0.38) CA2CA1TP53FDPS
SCHEMBL14837221 0.89 PRKCA (0.35) PRKCAPRKCDTSHRSMN1; SMN2CA2
SCHEMBL14836742 0.89 PRKCA (0.35) PRKCAPRKCDTSHRSMN1; SMN2CA2
SCHEMBL14779114 0.86 CA12 (0.34) PRKCAPRKCDCA2CA1
SCHEMBL27928967 0.85 TP53 (0.39) CA2CA1TP53FDPSDNM1
SCHEMBL14837435 0.83 TP53 (0.38) CA2CA1TP53FDPS
SCHEMBL27907097 0.83 TP53 (0.35) PRKCAPRKCDTSHRCA2CA1
SCHEMBL14779809 0.83 ALDH1A1 (0.37) PRKCAPRKCDTSHRSMN1; SMN2CA2
SCHEMBL14837350 0.82 FAAH (0.38) CA2CA1TP53FDPS
SCHEMBL14779949 0.81

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