SCHEMBL5332433

SCHEMBL5332433

O[CH]c1ccc(O)c(O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.67
KDM4E B2RXH2 5/20 0.61
RAB9A P51151 2/20 0.61
PTGS2 P35354 1/20 0.61
POLB P06746 3/20 0.58
BLM P54132 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
GFER P55789 2/20 0.58
ALPL P05186 2/20 0.58
ALPI P09923 1/20 0.58
ALPG P10696 1/20 0.58
NQO2 P16083 1/20 0.56
CYP3A4 P08684 4/20 0.54
ALDH1A1 P00352 4/20 0.54
HSD17B10 Q99714 4/20 0.54
ALOX12 P18054 3/20 0.54
CYP2C9 P11712 3/20 0.54
HIF1A Q16665 3/20 0.54
MEN1 O00255 3/20 0.54
LMNA P02545 3/20 0.54

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
SCHEMBL31706727 0.80 LCK (1.00) LCKKDM4ERAB9APTGS2POLB
SCHEMBL1824176 0.80 LCK (1.00) LCKKDM4ERAB9APTGS2POLB
SCHEMBL1824175 0.80 LCK (1.00) LCKKDM4ERAB9APTGS2POLB
SCHEMBL30631591 0.80 LCK (1.00) LCKKDM4ERAB9APTGS2POLB
SCHEMBL14281154 0.79 LCK (0.76) LCKKDM4ERAB9APTGS2POLB
SCHEMBL10335571 0.78 LCK (0.94) LCKKDM4ERAB9APTGS2POLB
SCHEMBL11001027 0.77 TSHR (0.52) LCKKDM4ERAB9APTGS2ALDH1A1
Protocatechualdehyde SCHEMBL9512877 0.76 KDM4E (1.00) LCKKDM4ERAB9APTGS2POLB
SCHEMBL17273589 0.76 LCK (0.64) LCKKDM4ERAB9APTGS2POLB
SCHEMBL18995241 0.76 LCK (0.64) LCKKDM4ERAB9APTGS2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1301279-B1 ADSORPTION METHOD AND LIGANDS CYTIVA BIOPROCESS R & D AB (SE) 2020-10-28 EP disclosed
US-7214321-B2 Adsorption method and ligands GE HEALTHCARE BIO-SCIENCES AB (SE) 2007-05-08 US disclosed
US-20040256324-A1 Adsorption method and ligands CYTIVA BIOPROCESS R&D AB (SE) 2004-12-23 US disclosed
EP-1301279-A2 ADSORPTION METHOD AND LIGANDS Amersham Pharmacia Biotech AB (SE) 2003-04-16 EP disclosed
WO-2002005959-A2 ADSORPTION METHOD AND LIGANDS AMERSHAM BIOSCIENCES AB (SE) 2002-01-24 WO disclosed