SCHEMBL569329

SCHEMBL569329

Cc1c(C(=O)Nc2ccc(C(=O)NCCCN)cc2)n[nH]c1-c1ccco1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.42
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 2/20 0.41
MCL1 Q07820 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
BLM P54132 1/20 0.41
CASP7 P55210 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TP53 P04637 3/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 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
SCHEMBL570487 0.90 NPC1 (0.45) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL570415 0.87 PTPN7 (0.39) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL569244 0.84 MAPT (0.43) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL569407 0.83 LCLAT1 (0.45) MAPTTP53LMNA
SCHEMBL569794 0.74 MAPT (0.42) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL14955715 0.74 ALDH1A1 (0.45) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL569330 0.72 MAPK8 (0.42) MAPK8MAPTKDM4EALDH1A1MEN1
SCHEMBL569677 0.69 POLB (0.49) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL569981 0.69 L3MBTL1 (0.43) MAPK8MAPTKDM4EMEN1KMT2A
SCHEMBL569240 0.69 MCHR1 (0.45) MAPTMEN1KMT2ATP53

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-2601208-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY Graffinity Pharmaceuticals GmbH (DE) 2013-06-12 EP disclosed
WO-2012017021-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-09 WO disclosed