Ethohexadiol

Ethohexadiol

SCHEMBL1362659

CCCC(O)C(CC)CO.CCCC(O)C(CC)CO.CCCCC(CC)CO[Al]

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
ALDH1A1 P00352 7/20 0.46
CYP3A4 P08684 6/20 0.40
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
RECQL P46063 1/20 0.37
CA2 P00918 2/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
Ethohexadiol SCHEMBL2442063 0.84 LMNA (0.70) LMNAALDH1A1CYP3A4TSHRTDP1
Ethohexadiol SCHEMBL27697531 0.78 LMNA (0.79) LMNAALDH1A1CYP3A4TSHRHSD17B10
Ethohexadiol SCHEMBL10901986 0.77 LMNA (0.70) LMNAALDH1A1CYP3A4TSHR
Ethohexadiol SCHEMBL28084564 0.77 LMNA (0.76) LMNAALDH1A1CYP3A4TSHRHSD17B10
Ethohexadiol SCHEMBL8675214 0.76 LMNA (0.83) LMNAALDH1A1CYP3A4TSHRTDP1
Ethohexadiol SCHEMBL10454295 0.76 LMNA (0.83) LMNAALDH1A1CYP3A4TSHRTDP1
SCHEMBL22122578 0.76 LMNA (0.74) LMNAALDH1A1CYP3A4TSHRTDP1
SCHEMBL3627525 0.76 LMNA (0.74) LMNAALDH1A1CYP3A4TSHRTDP1
Ethohexadiol SCHEMBL6282991 0.76 LMNA (1.00) LMNAALDH1A1CYP3A4TSHRTDP1
Ethohexadiol SCHEMBL38007 0.76 LMNA (1.00) LMNAALDH1A1CYP3A4TSHRTDP1

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
US-8450411-B2 Curable composition having a silane-modified reactive thinner HENKEL AG & CO. KGAA (DE) 2013-05-28 US disclosed
US-20120108730-A1 CURABLE COMPOSITION HAVING A SILANE-MODIFIED REACTIVE THINNER HENKEL AG & CO. KGAA (DE) 2012-05-03 US disclosed
US-8067508-B2 Compositions consisting of partially silyl-terminated polymers HENKEL AG & CO. KGAA (DE) 2011-11-29 US disclosed
US-20100081757-A1 COMPOSITIONS CONSISTING OF PARTIALLY SILYL-TERMINATED POLYMERS HENKEL AG & CO. KGAA (DE) 2010-04-01 US disclosed