SCHEMBL5713286

SCHEMBL5713286

C=C(CC1CO1)C(=O)O.C=C(CC1CO1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
TET2 Q6N021 4/20 0.33
TET3 O43151 1/20 0.33
TET1 Q8NFU7 1/20 0.33
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
GRM1 Q13255 1/20 0.32
GRM2 Q14416 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TP53 P04637 2/20 0.31
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HBB P68871 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL184079 1.00
Ethylene SCHEMBL10456431 0.98 ALDH1A1 (0.38) ALDH1A1TET2TET3TET1GRIK1
SCHEMBL9766931 0.92 ALDH1A1 (0.35) ALDH1A1
SCHEMBL4853347 0.90 ALDH1A1 (0.38) ALDH1A1TET2
Acrylic Acid SCHEMBL10886312 0.90 ALOX15 (0.48) ALDH1A1ALOX15HSD17B10
Acrylic Acid SCHEMBL28413727 0.90 ALOX15 (0.48) ALDH1A1ALOX15HSD17B10
SCHEMBL4192797 0.88 ALDH1A1 (0.33) ALDH1A1
Acrylic Acid SCHEMBL21809394 0.88 ALOX15 (0.47) ALDH1A1ALOX15HSD17B10
SCHEMBL9766930 0.87 ALDH1A1 (0.33) ALDH1A1
SCHEMBL21630252 0.86 ALDH1A1 (0.31) ALDH1A1

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-0932844-B1 OPTICAL GUIDE ERICSSON TELEFON AB L M (SE) 2006-05-24 EP claimed