SCHEMBL570416

SCHEMBL570416

NCCCNC(=O)c1cc(NC(=O)c2cc(Cc3ccco3)[nH]n2)ccc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SIRT6 Q8N6T7 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
PKM P14618 2/20 0.36
SIRT3 Q9NTG7 1/20 0.36
HPGD P15428 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
CASP3 P42574 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
CDK1 P06493 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL569245 0.88 KMT2A (0.41) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL569330 0.87 MAPK8 (0.42) ALDH1A1MEN1KMT2AGAATDP1
SCHEMBL569408 0.87 MAPT (0.42) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL570488 0.86 NPC1 (0.50) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL570415 0.75 PTPN7 (0.39) ALDH1A1MEN1KMT2ASIRT6LMNA
SCHEMBL10182505 0.74 PTPN7 (0.41) ALDH1A1MEN1KMT2ASIRT6TDP1
SCHEMBL569756 0.72 DRD3 (0.54) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL569786 0.71 HCAR2 (0.48) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL569396 0.71 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL569400 0.71 HTT (0.38) ALDH1A1MEN1KMT2ATDP1HPGD

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