Di(Hydroxyethyl)Ether

Di(Hydroxyethyl)Ether

SCHEMBL6560874

CCC(=O)Oc1ccccc1.CCOCC.OCCOCCO

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.54
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
RECQL P46063 3/20 0.46
ESR1 P03372 2/20 0.46
HIF1A Q16665 2/20 0.46
ACHE P22303 1/20 0.44
RAB9A P51151 2/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 4/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
TP53 P04637 1/20 0.40
MEN1 O00255 1/20 0.40
CYP19A1 P11511 1/20 0.40
LGALS8 O00214 1/20 0.38

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
Ether SCHEMBL6560472 0.92 ELANE (0.58) ELANEKMT2ASMN1; SMN2RECQLESR1
Acetic Acid Phenyl Ester SCHEMBL140659 0.86 ELANE (0.49) ELANEKMT2ASMN1; SMN2RECQLRAB9A
Di(Hydroxyethyl)Ether SCHEMBL17377678 0.85 RECQL (0.49) KMT2ASMN1; SMN2RECQLESR1MEN1
Di(Hydroxyethyl)Ether SCHEMBL12971202 0.85 KMT2A (0.42) ELANEKMT2ASMN1; SMN2RECQLESR1
Di(Hydroxyethyl)Ether SCHEMBL12971384 0.85 ELANE (0.39) ELANEKMT2ASMN1; SMN2RECQLALDH1A1
Ether SCHEMBL6560461 0.85 ELANE (0.51) ELANEKMT2ASMN1; SMN2RECQLESR1
Ethylene Glycol SCHEMBL28649244 0.85 ELANE (0.66) ELANEKMT2ASMN1; SMN2RECQLESR1
Acetic Acid Phenyl Ester SCHEMBL19064982 0.84 ELANE (0.47) ELANEKMT2ASMN1; SMN2RECQLRAB9A
Di(Hydroxyethyl)Ether SCHEMBL5973014 0.83 PRSS1 (0.48) KMT2ASMN1; SMN2RECQLESR1LMNA
Propylene Glycol SCHEMBL6560844 0.83 ELANE (0.53) ELANEKMT2ASMN1; SMN2RECQLESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735403-B1 Liquid crystal orienting agent JSR CORP (JP) 2004-03-17 EP disclosed
US-5700860-A Liquid crystal orienting agent JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1997-12-23 US disclosed
EP-0735403-A1 Liquid crystal orienting agent JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-10-02 EP disclosed