SCHEMBL5570446

SCHEMBL5570446

O=C(CN1C(=O)C=CC1=O)OCCCCO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.59
GSK3B P49841 1/20 0.59
ALDH1A1 P00352 5/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
BLM P54132 1/20 0.43
WRN Q14191 1/20 0.43
HIF1A Q16665 1/20 0.43
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MGLL Q99685 3/20 0.36
FAAH O00519 2/20 0.36
APP P05067 2/20 0.35
HSP90AA1 P07900 1/20 0.35
TLR9 Q9NR96 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 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
SCHEMBL14868172 0.91 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL20637068 0.87 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL5160731 0.85 GSK3A (0.67) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15023535 0.83 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL14926801 0.83 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15023923 0.83 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15024105 0.83 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL15023925 0.83 GSK3A (0.65) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL4399107 0.83 GSK3A (0.69) GSK3AGSK3BALDH1A1HPGDCYP1A2
SCHEMBL20913710 0.81 GSK3A (0.57) GSK3AGSK3BALDH1A1HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238325-B2 Very small chemical device and flow rate adjusting method therefor KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2007-07-03 US disclosed
US-20030190265-A1 Very small chemical device and flow rate adjusting method therefor KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2003-10-09 US disclosed
EP-1327474-A1 VERY SMALL CHEMICAL DEVICE AND FLOW RATE ADJUSTING METHOD THEREFOR KAWAMURA INSTITUTE OF CHEMICAL RESEARCH (JP) 2003-07-16 EP disclosed