SCHEMBL14836742

SCHEMBL14836742

CCCCC(CC)OS(=O)(=O)CS(=O)(=O)OC(CC)CCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35
DNM1 Q05193 2/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA2 P00918 11/20 0.34
CA1 P00915 10/20 0.34
CTSK P43235 1/20 0.34
CYP3A4 P08684 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33
CA9 Q16790 7/20 0.32
CA12 O43570 3/20 0.32
CA7 P43166 3/20 0.32
CA14 Q9ULX7 3/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA5B Q9Y2D0 2/20 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
SCHEMBL14837435 0.94 TP53 (0.38) CA2CA1CA9CA12CA7
SCHEMBL14778331 0.89 PRKCA (0.36) PRKCAPRKCDDNM1TSHRSMN1; SMN2
SCHEMBL27907097 0.89 TP53 (0.35) PRKCAPRKCDTSHRCA2CA1
SCHEMBL14837221 0.88 PRKCA (0.35) PRKCAPRKCDTSHRSMN1; SMN2CA2
SCHEMBL14837009 0.87 CA12 (0.33) PRKCAPRKCDCA2CA1CA12
SCHEMBL14779605 0.86 TP53 (0.38) CA2CA1CA9CA12CA7
SCHEMBL14837350 0.84 FAAH (0.38) CA2CA1CA9CA12CA7
SCHEMBL27907130 0.83 TP53 (0.42) CA2CA1
SCHEMBL28208873 0.82 FAAH (0.36) CA2CA1CA9CA12CA7
SCHEMBL14836822 0.82

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-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