SCHEMBL7424857

SCHEMBL7424857

CC(=O)Oc1ccc2c(ccc(=O)n2Cc2cccc(-c3noc(C)n3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.48
RAB9A P51151 3/20 0.47
LMNA P02545 2/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
HCRTR1 O43613 4/20 0.45
HCRTR2 O43614 4/20 0.45
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ABCB11 O95342 1/20 0.41
DAO P14920 1/20 0.40
NPC1 O15118 2/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL7428420 0.91 MET (0.47) METRAB9ALMNATSHRNFKB1
SCHEMBL7433220 0.87 MET (0.49) METHCRTR1HCRTR2KMT2AL3MBTL1
SCHEMBL7421328 0.85 MET (0.52) METHCRTR1HCRTR2KMT2AL3MBTL1
SCHEMBL7424903 0.83 ALOX5AP (0.49) METHCRTR1HCRTR2KMT2AL3MBTL1
SCHEMBL7424860 0.83 HCRTR1 (0.50) METRAB9ALMNATSHRNFKB1
SCHEMBL7429461 0.80 MET (0.50) METHCRTR1HCRTR2KMT2AL3MBTL1
SCHEMBL783030 0.76 LMNA (0.65) RAB9ALMNATSHRNFKB1NFKB2
SCHEMBL7429033 0.76 ALOX5AP (0.48) METHCRTR1HCRTR2KMT2AL3MBTL1
SCHEMBL7421333 0.76 MET (0.53) METLMNAHCRTR1HCRTR2KMT2A
SCHEMBL7428425 0.76 MET (0.47) METLMNAHCRTR1HCRTR2L3MBTL1

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