SCHEMBL14102418

SCHEMBL14102418

COC(=O)c1cc(CC(C)C)cc(C(=O)OC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.54
HSD17B10 Q99714 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
LMNA P02545 2/20 0.47
KDM4E B2RXH2 4/20 0.47
GAA P10253 2/20 0.47
POLB P06746 2/20 0.47
NFKB1 P19838 1/20 0.47
XDH P47989 1/20 0.47
GFER P55789 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
FUT7 Q11130 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL16957647 0.90 SLC7A5 (0.52) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL2319081 0.90 CA12 (0.61) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL16956660 0.90 SLC7A5 (0.68) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL27387791 0.88 SLC7A5 (0.48) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL16956657 0.88 SLC7A5 (0.48) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL16957645 0.85 SLC7A5 (0.46) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL16958657 0.84 SLC7A5 (0.45) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL16958660 0.84 SLC7A5 (0.45) SLC7A5HSD17B10CA12CA1CA2
SCHEMBL1790854 0.82 SLC7A5 (0.68) SLC7A5KDM4ELOXL2CYP4F2CYP4A11
SCHEMBL17046379 0.81 LOXL2 (0.44) SLC7A5HSD17B10CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1695705-B1 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2008-08-06 EP disclosed