SCHEMBL4735293

SCHEMBL4735293

O=C(O)CCC(=O)OC(CCCCCCCCCCCS)COCCOCCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.39
TLR2 O60603 3/20 0.33
MAPT P10636 3/20 0.33
MAPK1 P28482 2/20 0.33
RECQL P46063 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
PLA2G2C Q5R387 1/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GSTK1 Q9Y2Q3 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
THRB P10828 1/20 0.31
HTT P42858 1/20 0.31
GMNN O75496 1/20 0.31
HSP90AA1 P07900 1/20 0.31
BLM P54132 1/20 0.31

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
Succinic Acid SCHEMBL4735296 0.81 FOLH1 (0.43) FOLH1PLA2G2CGSTK1
Triethylene Glycol SCHEMBL4735292 0.76 FOLH1 (0.41) FOLH1MAPTLMNAALDH1A1MEN1
SCHEMBL28616684 0.76 MEN1 (0.39) MAPTMAPK1MEN1KMT2ATHRB
SCHEMBL9615277 0.75 MAPT (0.61) MAPTMAPK1PRKCAPRKCEPRKCQ
SCHEMBL25303988 0.74 RECQL (0.49) TLR2MAPTMAPK1RECQLPRKCA
SCHEMBL25303987 0.74 RECQL (0.49) TLR2MAPTMAPK1RECQLPRKCA
SCHEMBL9995091 0.73 EPHX2 (0.37) MAPTRECQLPRKCAPRKCEPRKCQ
SCHEMBL6850050 0.72 MAPT (0.61) MAPTMAPK1PRKCAPRKCEPRKCQ
SCHEMBL6846091 0.72 MAPT (0.61) MAPTMAPK1PRKCAPRKCEPRKCQ
SCHEMBL3803336 0.72 MEN1 (0.35) MAPTMAPK1MEN1KMT2ATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008075887-A1 IMMOBILIZATION LINKERS FOR BIOMOLECULES DAEGU GYEONGBUK INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2008-06-26 WO disclosed