SCHEMBL28829385

SCHEMBL28829385

CCCCCCCCCC(N)OS(=O)(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.55
LAP3 P28838 2/20 0.44
GRIK1 P39086 2/20 0.43
GRIK2 Q13002 2/20 0.43
SPHK1 Q9NYA1 2/20 0.42
S1PR2 O95136 5/20 0.41
S1PR1 P21453 5/20 0.41
S1PR3 Q99500 5/20 0.41
S1PR4 O95977 4/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
CYP2D6 P10635 2/20 0.40
OPRM1 P35372 1/20 0.40
GMNN O75496 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
THPO P40225 1/20 0.40
MTOR P42345 1/20 0.40
BLM P54132 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL10782774 1.00 TP53 (0.55) TP53LAP3GRIK1GRIK2SPHK1
SCHEMBL6763149 1.00 TP53 (0.55) TP53LAP3GRIK1GRIK2SPHK1
SCHEMBL9439677 1.00 TP53 (0.55) TP53LAP3GRIK1GRIK2SPHK1
SCHEMBL10766852 1.00 TP53 (0.55) TP53LAP3GRIK1GRIK2SPHK1
SCHEMBL10777854 0.98 TP53 (0.57) TP53LAP3GRIK1GRIK2SPHK1
Tetradecane SCHEMBL2761407 0.93 TP53 (0.49) TP53LAP3GRIK1GRIK2SPHK1
Tetradecane SCHEMBL4197990 0.85 TP53 (0.46) TP53LAP3SPHK1S1PR2S1PR1
SCHEMBL10812506 0.84 TP53 (0.48) TP53LAP3GRIK1GRIK2SPHK1
SCHEMBL10782786 0.84 TP53 (0.42) TP53GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL11566006 0.82 CA2 (0.48) TP53LAP3GRIK1GRIK2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105521697-B Remove the absorbent and removal methods of monoxone sulfur dioxide in tail gas 河北科技大学 2019-01-04 CN claimed
CN-105521697-A Absorbent for removing sulfur dioxide in chloroacetic acid tail gas and removal method UNIV HEBEI SCIENCE & TECH 2016-04-27 CN claimed
CN-105521697-B Remove the absorbent and removal methods of monoxone sulfur dioxide in tail gas 河北科技大学 2019-01-04 CN disclosed
CN-105521697-A Absorbent for removing sulfur dioxide in chloroacetic acid tail gas and removal method UNIV HEBEI SCIENCE & TECH 2016-04-27 CN disclosed