SCHEMBL6249646

SCHEMBL6249646

C=C(CCC(N)CO)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.43
GRIK2 Q13002 2/20 0.43
GRM1 Q13255 2/20 0.43
GRM2 Q14416 2/20 0.43
ENPEP Q07075 7/20 0.39
ANPEP P15144 3/20 0.39
LTA4H P09960 1/20 0.36
TET2 Q6N021 3/20 0.35
TET3 O43151 1/20 0.35
TET1 Q8NFU7 1/20 0.35
BLM P54132 2/20 0.33
KMT2A Q03164 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL15772326 0.83 GRIK1 (0.43) GRIK1GRIK2GRM1GRM2ENPEP
SCHEMBL5201802 0.79 GRIK1 (0.48) GRIK1GRIK2GRM1GRM2ENPEP
SCHEMBL5275612 0.77 TET2 (0.38) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL932746 0.77
SCHEMBL289109 0.77
SCHEMBL6515001 0.77
SCHEMBL9321915 0.76 GRIK1 (0.61) GRIK1GRIK2GRM1GRM2TET2
SCHEMBL50117 0.76 GABRP (0.60) GRIK1GRIK2GRM1GRM2LTA4H
SCHEMBL243507 0.76 TET2 (0.41) GRIK1GRIK2GRM1GRM2TET2
Water SCHEMBL10629808 0.74 TET2 (0.40) GRIK1GRIK2GRM1GRM2TET2

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
EP-1564549-A1 Calibrating electrochemical sensors, especially pH electrodes Hamilton Bonaduz AG (CH) 2005-08-17 EP disclosed