SCHEMBL2636634

SCHEMBL2636634

Nc1nc([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)nc2nc[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.43
GDA Q9Y2T3 1/20 0.43
HIF1A Q16665 3/20 0.40
PYGL P06737 4/20 0.37
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
STAT6 P42226 1/20 0.37
KDR P35968 1/20 0.37
AURKB Q96GD4 1/20 0.37
PNP P00491 1/20 0.37

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
SCHEMBL7752119 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL5182602 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL8331267 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL4436406 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL9393271 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL2010793 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL1994118 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL240029 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL8509311 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E
SCHEMBL31624452 1.00 PDPK1 (0.43) PDPK1GDAHIF1APYGLKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113980076-A Flame retardant and preparation method thereof 盐城工业职业技术学院 2022-01-28 CN claimed
CN-110291095-B Adenosine analogues and their use in regulating circadian clock 北京生命科学研究所 2023-04-18 CN disclosed
WO-2018075264-A1 CHEMICALLY MODIFIED RNA APTAMERS AND USES THEREOF ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) 2018-04-26 WO disclosed
WO-2014011465-A2 APTAMER-TARGETED ANTIGEN DELIVERY ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2014-01-16 WO disclosed
WO-2013163303-A2 TRANSFERRIN RECEPTOR APTAMERS AND APTAMER-TARGETED DELIVERY ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2013-10-31 WO disclosed
WO-2011142798-A2 METHODS OF PREPARING TARGETED APTAMER PRODRUGS ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2011-11-17 WO disclosed