SCHEMBL13286563

SCHEMBL13286563

CCC(=O)C(=O)N1CCC[C@H]1CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ACE P12821 3/20 0.39
REN P00797 2/20 0.39
F2 P00734 2/20 0.34
PRSS1 P07477 2/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
DPP4 P27487 2/20 0.34
FAP Q12884 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
LTA4H P09960 2/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33

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
SCHEMBL14407891 0.92 POLB (0.45) POLBL3MBTL1ACERENF2
SCHEMBL14407812 0.85 POLB (0.40) POLBL3MBTL1ACERENF2
SCHEMBL2770743 0.84 GPR84 (0.46) MEN1KMT2AOPRD1
SCHEMBL2769589 0.84 GPR84 (0.46) MEN1KMT2AOPRD1
SCHEMBL14407896 0.84 POLB (0.49) POLBL3MBTL1ACERENF2
SCHEMBL14407813 0.82 POLB (0.44) POLBL3MBTL1ACERENNPC1
SCHEMBL14407893 0.81 POLB (0.42) POLBL3MBTL1MEN1KMT2AOPRD1
SCHEMBL24260264 0.79 L3MBTL1 (0.50) POLBL3MBTL1DPP4FAPDPP8
SCHEMBL14407901 0.79 ALOX5 (0.47) MEN1KMT2A
SCHEMBL14407900 0.79 ALOX5 (0.47) MEN1KMT2A

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
US-7745489-B2 Compositions and methods for inhibition of phospholipase A2 mediated inflammation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-06-29 US disclosed