SCHEMBL7425441

SCHEMBL7425441

Cc1nc(-c2cccc(Oc3ccc(N)cc3)c2)no1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.60
SMN1; SMN2 Q16637 6/20 0.56
RAB9A P51151 6/20 0.56
TP53 P04637 5/20 0.56
NPC1 O15118 5/20 0.56
LMNA P02545 4/20 0.56
GAA P10253 2/20 0.56
HTT P42858 2/20 0.56
MAPK1 P28482 2/20 0.56
ALDH1A1 P00352 3/20 0.51
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
NFKB1 P19838 3/20 0.50
NFKB2 Q00653 3/20 0.50
RELA Q04206 3/20 0.50
MITF O75030 1/20 0.50
GFER P55789 1/20 0.50
NLRP1 Q9C000 1/20 0.50
NOD2 Q9HC29 1/20 0.50

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
SCHEMBL7427868 0.82 L3MBTL1 (0.51) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL7421268 0.81 MAPT (0.60) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL16067423 0.80 L3MBTL1 (0.72) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL1353440 0.79 L3MBTL1 (0.77) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL8934807 0.77 RAB9A (0.74) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL13130238 0.77 L3MBTL1 (1.00) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL7422357 0.77 L3MBTL1 (0.51) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL7422180 0.76 LMNA (0.64) L3MBTL1SMN1; SMN2RAB9ATP53NPC1
SCHEMBL1353609 0.76 CA12 (0.62) L3MBTL1RAB9ANPC1LMNAHTT
SCHEMBL29626126 0.75 ALDH1A1 (0.79) SMN1; SMN2RAB9ANPC1LMNAGAA

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