SCHEMBL30516556

SCHEMBL30516556

CCCCCCCCCOC(=O)/C=C/c1ccc(O)cc1

nearest known ligand 0.89

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.73
CA12 O43570 5/20 0.68
CA7 P43166 5/20 0.68
CA9 Q16790 5/20 0.68
CA14 Q9ULX7 5/20 0.68
CA1 P00915 4/20 0.68
CA2 P00918 2/20 0.68
AKR1B10 O60218 3/20 0.63
AKR1B1 P15121 3/20 0.63
CA4 P22748 3/20 0.62
CA6 P23280 3/20 0.62
CA5A P35218 3/20 0.62
CA5B Q9Y2D0 3/20 0.62
MET P08581 1/20 0.62
ESR1 P03372 1/20 0.62
MAOB P27338 1/20 0.58
ABCG2 Q9UNQ0 1/20 0.56
TYR P14679 1/20 0.55
HCAR2 Q8TDS4 1/20 0.54

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
SCHEMBL28116687 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL27864031 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL19359006 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL27658775 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL28126782 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL21001200 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL19359004 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL10299697 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL30946730 1.00 APP (0.73) APPCA12CA7CA9CA14
SCHEMBL6397881 1.00 APP (0.73) APPCA12CA7CA9CA14

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
CN-114601821-B Application of compound in preparation of product with antiviral effect 暨南大学 2023-07-28 CN disclosed