SCHEMBL7430625

SCHEMBL7430625

Cc1nc(-c2cccc(Oc3cccc4c(C)cc(=O)[nH]c34)c2)no1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 4/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
SCN9A Q15858 1/20 0.42
HCRTR1 O43613 3/20 0.39
HCRTR2 O43614 3/20 0.39
MAPT P10636 3/20 0.38
DAO P14920 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HTR6 P50406 1/20 0.37
CYP19A1 P11511 1/20 0.36
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 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
SCHEMBL7424914 0.87 L3MBTL1 (0.43) NQO2L3MBTL1TP53RAB9ANPC1
SCHEMBL7430617 0.83 L3MBTL1 (0.49) L3MBTL1TP53RAB9ANPC1LMNA
SCHEMBL7426351 0.83 L3MBTL1 (0.49) L3MBTL1TP53RAB9ANPC1LMNA
SCHEMBL7424909 0.75 L3MBTL1 (0.44) L3MBTL1TP53RAB9ANPC1LMNA
SCHEMBL16067423 0.70 L3MBTL1 (0.72) L3MBTL1TP53RAB9ANPC1SMN1; SMN2
SCHEMBL7425441 0.69 L3MBTL1 (0.60) L3MBTL1TP53RAB9ANPC1LMNA
SCHEMBL7424881 0.69 SLC6A4 (0.52) L3MBTL1TP53RAB9ANPC1SMN1; SMN2
SCHEMBL5433980 0.69 NQO2 (1.00) NQO2L3MBTL1LMNASMN1; SMN2GAA
SCHEMBL7433951 0.68 L3MBTL1 (0.43) L3MBTL1TP53RAB9ANPC1LMNA
SCHEMBL13130238 0.68 L3MBTL1 (1.00) L3MBTL1TP53RAB9ANPC1SMN1; SMN2

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-1107954-A1 2-OXO-$i(2H)-QUINOLINE DERIVATIVES MERCK PATENT GmbH (DE) 2001-06-20 EP disclosed
WO-2000012479-A1 2-OXO-2H-QUINOLINE DERIVATIVES MERCK PATENT GMBH (DE) 2000-03-09 WO disclosed