SCHEMBL4649161

SCHEMBL4649161

Cc1ccc2[nH]c(=O)c(C(=O)NCC(=O)OC(C)(C)C)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
KDM4E B2RXH2 9/20 0.50
HSD17B10 Q99714 6/20 0.50
HPGD P15428 4/20 0.48
GAA P10253 2/20 0.48
ALOX15 P16050 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
KMT2A Q03164 3/20 0.47
DAO P14920 1/20 0.47
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
THRB P10828 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PTPRC P08575 2/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL4649667 0.84 DAO (0.52) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL1366351 0.77 DAO (0.65) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL12082628 0.75 ALDH1A1 (0.61) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL15564491 0.75 DAO (0.54) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL10969986 0.73 KDM4E (0.66) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL12301492 0.70 TDP1 (0.65) ALDH1A1GAAKMT2ARAB9ANPC1
SCHEMBL832227 0.70 RAB9A (0.67) ALDH1A1KDM4EHSD17B10HPGDKMT2A
SCHEMBL22223088 0.70 DAO (0.58) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL30705547 0.68 KDM4E (0.52) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL30705638 0.68 KDM4E (0.50) ALDH1A1KDM4EHSD17B10HPGDGAA

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-1960363-A2 QUINOLONE BASED COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF Amgen, Inc. (US) 2008-08-27 EP disclosed
WO-2007070359-A2 QUINOLONE BASED COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2007-06-21 WO disclosed