SCHEMBL4648517

SCHEMBL4648517

COC(=O)c1c(O)c2ccc(C)c(OC)c2[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
CYP19A1 P11511 2/20 0.42
NQO2 P16083 2/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PADI4 Q9UM07 1/20 0.40
KDM5A P29375 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
PPARG P37231 1/20 0.38
NR4A2 P43354 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GRIN2D O15399 1/20 0.37

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
SCHEMBL322275 0.78 USP2 (0.44) USP2KDM4EALDH1A1MEN1KMT2A
SCHEMBL14335867 0.76 USP2 (0.44) USP2CYP19A1NQO2KDM4EALDH1A1
SCHEMBL16098758 0.73 USP2 (0.44) USP2KDM4EALDH1A1MEN1KMT2A
SCHEMBL18073576 0.70 CYP19A1 (0.46) CYP19A1NQO2KDM4EALDH1A1HPGD
SCHEMBL30681958 0.70 KDM4E (0.71) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL1622313 0.70 KDM4E (0.71) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL9515279 0.70 KDM4E (0.39) KDM4EALDH1A1KMT2AHPGDHSD17B10
SCHEMBL3986764 0.69 MEN1 (0.47) USP2KDM4EALDH1A1MEN1KMT2A
SCHEMBL8018550 0.69 MEN1 (0.64) ALDH1A1MEN1KMT2A
SCHEMBL30037913 0.69 MEN1 (0.64) ALDH1A1MEN1KMT2A

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