SCHEMBL3634892

SCHEMBL3634892

CCCOCC(C)O.CCOC(=O)OCC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.69
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 3/20 0.50
SOAT1 P35610 1/20 0.41
MAPT P10636 2/20 0.41
USP2 O75604 1/20 0.35
HTT P42858 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
PLA2G2C Q5R387 2/20 0.33
TSHR P16473 1/20 0.32
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SPHK1 Q9NYA1 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
SCHEMBL20491931 0.87 HSD17B10 (0.67) HSD17B10TDP1ALDH1A1SOAT1MAPT
Ethyl Acetate SCHEMBL152685 0.87 HSD17B10 (0.67) HSD17B10TDP1ALDH1A1MAPTUSP2
Propylene Glycol SCHEMBL3634889 0.85 ALDH1A1 (0.50) HSD17B10TDP1ALDH1A1SOAT1MAPT
SCHEMBL17164541 0.83
SCHEMBL21356623 0.83 HSD17B10 (1.00) HSD17B10TDP1ALDH1A1MAPTUSP2
SCHEMBL9637969 0.83
SCHEMBL34792 0.83
Acetic Acid SCHEMBL3099063 0.82 HSD17B10 (0.78) HSD17B10TDP1ALDH1A1MAPTUSP2
SCHEMBL3796747 0.81 HSD17B10 (0.86) HSD17B10TDP1ALDH1A1MAPTUSP2
Ether SCHEMBL5972966 0.81 HSD17B10 (0.86) HSD17B10TDP1ALDH1A1MAPTUSP2

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
EP-2164648-A1 LOW K DIELECTRIC Sba Materials, Inc. (US) 2010-03-24 EP disclosed
WO-2008156680-A1 LOW K DIELECTRIC SBA MATERIALS, INC. (US) 2008-12-24 WO disclosed