Di(Hydroxyethyl)Ether

Di(Hydroxyethyl)Ether

SCHEMBL27943641

CCCCOP(=O)(O)OCCCC.OCCOCCO

nearest known ligand 0.61

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
CYP3A4 P08684 2/20 0.50
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
LPAR3 Q9UBY5 6/20 0.48
LPAR2 Q9HBW0 4/20 0.48
LPAR1 Q92633 3/20 0.48
PLA2G2C Q5R387 1/20 0.45
P2RY10 O00398 1/20 0.42
MAPK1 P28482 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
SCHEMBL26758426 0.96 TSHR (0.57) TSHRCYP3A4MEN1THRBHTT
SCHEMBL27743684 0.96 TSHR (0.57) TSHRCYP3A4MEN1THRBHTT
SCHEMBL21694818 0.92 CYP3A4 (0.54) TSHRCYP3A4LPAR3LPAR2LPAR1
Di(Hydroxyethyl)Ether SCHEMBL21694831 0.89 TSHR (0.53) TSHRCYP3A4MEN1THRBHTT
SCHEMBL22974809 0.89 MEN1 (0.63) TSHRCYP3A4MEN1THRBHTT
SCHEMBL19511989 0.89 MEN1 (0.63) TSHRCYP3A4MEN1THRBHTT
SCHEMBL19511826 0.89 MEN1 (0.63) TSHRCYP3A4MEN1THRBHTT
SCHEMBL29093875 0.89 TSHR (0.60) TSHRCYP3A4MEN1THRBHTT
Di(Hydroxyethyl)Ether SCHEMBL27743685 0.88 LPAR3 (0.64) TSHRCYP3A4MEN1THRBHTT
SCHEMBL12914745 0.88 CYP3A4 (0.63) TSHRCYP3A4LPAR3LPAR2LPAR1

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
CN-103635497-A Method for polymerizing resin casting for use as epoxy acrylic optical lens and resin composition containing internal releasing agent for use in epoxy acrylic optical lens KOC SOLUTION CO LTD 2014-03-12 CN disclosed