SCHEMBL7194597

SCHEMBL7194597

C=CC(=O)OCCO.C=CC(=O)Oc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.66
TSHR P16473 5/20 0.63
ALDH1A1 P00352 5/20 0.44
TP53 P04637 3/20 0.44
HIF1A Q16665 3/20 0.44
CYP3A4 P08684 2/20 0.44
RECQL P46063 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGD P15428 1/20 0.41
PDE6D O43924 1/20 0.40
GAA P10253 1/20 0.39
THRA P10827 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TGM2 P21980 1/20 0.37
MAPK1 P28482 1/20 0.37
AKR1B10 O60218 1/20 0.36

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
Diphenylether SCHEMBL2453207 0.90 THRB (0.66) THRBTSHRALDH1A1TP53HIF1A
Di(Hydroxyethyl)Ether SCHEMBL9738612 0.88 THRB (0.54) THRBTSHRALDH1A1TP53HIF1A
Ethylene Glycol SCHEMBL2694080 0.88 THRB (0.56) THRBTSHRALDH1A1RECQLHSD17B10
SCHEMBL5350028 0.87 THRB (0.62) THRBTSHRALDH1A1TP53HIF1A
Triethylene Glycol SCHEMBL2376419 0.87 THRB (0.53) THRBTSHRALDH1A1TP53HIF1A
Benzene SCHEMBL11756759 0.86 TSHR (0.86) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL11755412 0.85 THRB (0.64) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL28102015 0.85 THRB (0.64) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL28272336 0.85 THRB (0.52) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL28916 0.84 THRB (0.58) THRBALDH1A1TP53CYP3A4HSD17B10

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-6596787-B1 Low intensity UV curable adhesives formulated using a blend of acrylate oligomers and monomers which are capable of bonding glass, provide improved low-yellowing properties and fast cure speed over current glass bonding adhesives, bonding strength HENKEL LOCTITE CORPORATION 2003-07-22 US disclosed
EP-0836121-B1 Toner for developing electrostatic image, and image forming method CANON KK (JP) 2001-06-06 EP disclosed
US-5955234-A COMPRISED OF BINDER RESIN, COLORANT AND WAX CANON KABUSHIKI KAISHA (JP) 1999-09-21 US disclosed
EP-0836121-A1 Toner for developing electrostatic image, and image forming method CANON KABUSHIKI KAISHA (JP) 1998-04-15 EP disclosed