SCHEMBL14458034

SCHEMBL14458034

C=Cc1cccc(C(C)C)c1N1C(=O)c2ccc3c4ccc5c6ccc7c8c(ccc(c9ccc(c%10ccc(c2c3%10)C1=O)c4c59)c86)C(=O)N(c1c(C(C)C)cccc1C(C)C)C7=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 5/20 0.49
DPP4 P27487 5/20 0.49
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
TERT O14746 2/20 0.33
STAT3 P40763 1/20 0.32
HIF1A Q16665 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.31
TP53 P04637 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
THRB P10828 1/20 0.31
TLR9 Q9NR96 1/20 0.31
MEN1 O00255 1/20 0.31
RGS12 O14924 1/20 0.31
USP2 O75604 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL12206252 0.95 ANPEP (0.45) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL10269051 0.93 ANPEP (0.43) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL3438530 0.88 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL29461625 0.88 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL13478139 0.88 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL18071847 0.88 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL29369271 0.88 ANPEP (0.60) ANPEPDPP4NR1H2NR1H3TERT
SCHEMBL13644548 0.87 AKR1B1 (0.42) ANPEPDPP4NR1H2NR1H3MEN1
SCHEMBL14028760 0.87 ANPEP (0.39) ANPEPDPP4NR1H2NR1H3LMNA
SCHEMBL13784711 0.87 ANPEP (0.45) ANPEPDPP4NR1H2NR1H3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007093643-A1 FLUORINATED RYLENETETRACARBOXYLIC ACID DERIVATIVES AND USE THEREOF BASF SE (DE) 2007-08-23 WO disclosed