SCHEMBL7424909

SCHEMBL7424909

Cc1nc(-c2cccc(Oc3ccc4[nH]c(=O)cc(C(Br)Br)c4c3)c2)no1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HTT P42858 2/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
TSHR P16473 1/20 0.39
DAO P14920 1/20 0.38
HTR6 P50406 1/20 0.37
HPGD P15428 1/20 0.37
SCN9A Q15858 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL7430617 0.89 L3MBTL1 (0.49) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7424914 0.85 L3MBTL1 (0.43) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7426351 0.83 L3MBTL1 (0.49) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7430625 0.75 NQO2 (0.50) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7433951 0.72 L3MBTL1 (0.43) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7425441 0.71 L3MBTL1 (0.60) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7421268 0.69 MAPT (0.60) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL7424249 0.68 LMNA (0.46) L3MBTL1RAB9ANPC1LMNATP53
SCHEMBL16067423 0.68 L3MBTL1 (0.72) L3MBTL1RAB9ANPC1TP53SMN1; SMN2
SCHEMBL7422357 0.68 L3MBTL1 (0.51) L3MBTL1RAB9ANPC1LMNATP53

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