SCHEMBL3363705

SCHEMBL3363705

CC(=O)CCc1nc(C2CCCCC2)co1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
KMO O15229 1/20 0.33
CNR2 P34972 1/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
CTSK P43235 3/20 0.33
CTSS P25774 2/20 0.33
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FPR2 P25090 1/20 0.32
MEN1 O00255 1/20 0.32
ABL1 P00519 1/20 0.32
HTT P42858 1/20 0.31
PSMB8 P28062 1/20 0.31
PSMB9 P28065 1/20 0.31
PSMB5 P28074 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
SCHEMBL3424196 0.85 KMO (0.35) L3MBTL1KMOCNR2CTSKCTSS
SCHEMBL3396241 0.78 CTSK (0.34) L3MBTL1KMOCNR2CTSKCTSS
SCHEMBL3362566 0.78 PSMB8 (0.34) KMOCNR2ABL1PSMB8PSMB9
SCHEMBL3363702 0.77 ABL1 (0.34) L3MBTL1KMOCNR2CTSKCTSS
SCHEMBL3362563 0.76 PSMB8 (0.35) L3MBTL1KMOKMT2AHPGDMEN1
SCHEMBL3422558 0.75 ABL1 (0.37) L3MBTL1KMOCNR2HPGDABL1
SCHEMBL3361922 0.71 RORC (0.41) KMOCNR2MAPTCTSKCTSS
SCHEMBL24258815 0.71 HPGD (0.39) L3MBTL1MAPTHPGDFPR2
SCHEMBL10263650 0.68 USP7 (0.34) CNR2
SCHEMBL2262247 0.68 L3MBTL1 (0.38) L3MBTL1CTSKCTSSPSMB5

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
WO-2010046780-A2 ANTI VIRAL COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2010-04-29 WO disclosed