SCHEMBL3894761

SCHEMBL3894761

CCCOCC(C)OCC(C)OCC(C)OCC(C)OCC(C)O

nearest known ligand 0.96

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.96
HSD17B10 Q99714 1/20 0.68
USP2 O75604 1/20 0.37
HTT P42858 1/20 0.36
SPHK1 Q9NYA1 1/20 0.33
MAPK1 P28482 1/20 0.32
LPAR5 Q9H1C0 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.31

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
SCHEMBL55748 1.00 TDP1 (0.96) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL2956696 1.00 TDP1 (0.96) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL55595 0.98 TDP1 (1.00) TDP1HSD17B10USP2HTTSPHK1
Di(Hydroxyethyl)Ether SCHEMBL8434582 0.89 TDP1 (0.82) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL23064090 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL11134268 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL1900358 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL548998 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL1901966 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1
SCHEMBL18718091 0.88 TDP1 (0.75) TDP1HSD17B10USP2HTTSPHK1

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
US-20090176925-A1 DISPERSING AGENT TOAGOSEI CO., LTD. (JP) 2009-07-09 US disclosed
EP-2025394-A1 DISPERSING AGENT Toagosei Co., Ltd (JP) 2009-02-18 EP disclosed