SCHEMBL28359088

SCHEMBL28359088

C=C(CC(COC)COC)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 4/20 0.45
TET3 O43151 1/20 0.45
TET1 Q8NFU7 1/20 0.45
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
GRM1 Q13255 1/20 0.43
GRM2 Q14416 1/20 0.43
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8656065 0.81 TET2 (0.48) TET2TET3TET1GRIK1GRIK2
SCHEMBL27811981 0.77 CACNA2D1 (0.41) ALDH1A1ALOX15
SCHEMBL9436773 0.75 TET2 (0.50) TET2TET3TET1GRIK1GRIK2
SCHEMBL3413855 0.75 TET2 (0.50) TET2TET3TET1GRIK1GRIK2
SCHEMBL8022411 0.73 TET2 (0.48) TET2TET3TET1GRIK1GRIK2
SCHEMBL10632668 0.72 TDP1 (0.30)
SCHEMBL13039797 0.72 ALDH1A1 (0.43) ALDH1A1
SCHEMBL29044144 0.71 TET2 (0.52) TET2TET3TET1GRIK1GRIK2
SCHEMBL15717818 0.71 TET2 (0.46) TET2TET3TET1GRIK1GRIK2
SCHEMBL377902 0.71 TET2 (0.46) TET2TET3TET1GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110651387-B Sulfur-carbon material composite, positive electrode material for lithium-sulfur secondary battery, and lithium-sulfur secondary battery 积水化学工业株式会社 2023-02-17 CN disclosed
CN-110651387-A Sulfur-carbon material composite, positive electrode material for lithium-sulfur secondary battery, and lithium-sulfur secondary battery 积水化学工业株式会社 2020-01-03 CN disclosed