SCHEMBL569267

SCHEMBL569267

COc1ccc(NC(=O)c2n[nH]c(-c3cccs3)c2C)cc1C(=O)NCCCN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KMT2A Q03164 9/20 0.41
MEN1 O00255 7/20 0.40
LMNA P02545 4/20 0.40
TP53 P04637 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GLA P06280 1/20 0.39
XIAP P98170 1/20 0.39
SHMT2 P34897 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL569395 0.88 ALDH1A1 (0.38) MAPTALDH1A1KDM4ENPSR1HSD17B10
SCHEMBL569240 0.86 MCHR1 (0.45) MAPTKMT2AMEN1TP53
SCHEMBL569973 0.85 CHEK1 (0.38)
SCHEMBL569399 0.84 TTK (0.39) MAPTKMT2AMEN1
SCHEMBL569927 0.84 KIT (0.36) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL569785 0.84 HDAC8 (0.42) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL569244 0.84 MAPT (0.43) MAPTALDH1A1KDM4EHPGDNPSR1
SCHEMBL570105 0.81 NPC1 (0.43) MAPTKDM4EKMT2AMEN1TP53
SCHEMBL570137 0.80 BACE1 (0.40) MAPTHPGDKMT2AMEN1SMN1; SMN2
SCHEMBL570358 0.79 ABL1 (0.43) MAPTKMT2APOLB

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