SCHEMBL7015629

SCHEMBL7015629

CCOC(=O)c1c(C2=CCCC=C2)[nH]c2cc(N3CCN(C)CC3)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.41
ALDH1A1 P00352 7/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 3/20 0.41
GAA P10253 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
RAD52 P43351 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
DRD3 P35462 1/20 0.39
GLA P06280 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL11208613 0.79 GAA (0.47) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7011748 0.79 ALOX5 (0.46) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7020424 0.76 ALOX5 (0.46) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7013585 0.75 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7014803 0.75 KIF11 (0.52) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7016365 0.72 KDM4E (0.54) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7149603 0.71 ALOX5 (0.43) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7013967 0.71 PRKD3 (0.42) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7016620 0.69 KIF11 (0.42) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL9523291 0.69 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10GAA

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-1313708-A1 QUINOLINE ANTIBACTERIAL COMPOUNDS AND METHODS OF USE THEREOF CHIRON CORPORATION (US) 2003-05-28 EP disclosed
WO-2002018345-A1 QUINOLINE ANTIBACTERIAL COMPOUNDS AND METHODS OF USE THEREOF CHIRON CORPORATION (US) 2002-03-07 WO disclosed