SCHEMBL7519403

SCHEMBL7519403

C=CC(=O)OS(OCC)(OCC)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.40
THRA P10827 1/20 0.37
ATM Q13315 1/20 0.36
RAB9A P51151 1/20 0.36
HSD11B1 P28845 2/20 0.36
CYP2C19 P33261 1/20 0.36
MCL1 Q07820 1/20 0.36
PSIP1 O75475 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
AKT1 P31749 1/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL7518288 0.78 ALDH1A1 (0.40) THRBATMHSD11B1PSIP1KMT2A
SCHEMBL27805767 0.75 THRB (0.41) THRBTHRARAB9AHSD11B1CYP2C19
SCHEMBL501366 0.74 THRB (0.43) THRBTHRARAB9ACYP2C19MCL1
SCHEMBL10408130 0.73 THRB (0.42) THRBCYP2C19KMT2AAKT1TSHR
SCHEMBL5080061 0.71 ATM (0.41) THRBTHRAATMRAB9AHSD11B1
Acrylic Acid Ethyl Ester SCHEMBL28876839 0.69 THRB (0.50) THRBTHRARAB9AKMT2AMEN1
SCHEMBL27682293 0.69 TSHR (0.39) THRBTSHRMAPK1CYP3A4ALDH1A1
Biphenyl SCHEMBL17893027 0.68 THRB (0.53) THRBRAB9AKMT2AMEN1TSHR
Acrylic Acid Ethyl Ester SCHEMBL7116609 0.68 THRB (0.53) THRBKMT2AMEN1TSHRALDH1A1
SCHEMBL28178580 0.67 TSHR (0.38) THRBTSHRMAPK1CYP3A4ALDH1A1

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
EP-0735062-B1 ACTINIC-RADIATION-CURABLE COMPOSITION AND LENS SHEET MITSUBISHI RAYON CO (JP) 2002-01-30 EP claimed
US-6206550-B1 BACKLIGHT WITH LENS PORTION MADE FROM A CURABLE COMPOSITION WHICH INCLUDES A BIS(4-(METH)ACRYLOYL-THIOPHENYL) SULFIDE AND (METH)ACRYLATES; HIGH BRIGHTNESS-ENHANCING EFFECT ON LENSES OF PROJECTION TVS AND STEREOSCOPIC PHOTOGRAPHY. MITSUBISHI RAYON COMPANY LTD. (JP) 2001-03-27 US claimed
US-5969867-A ACRYLIC ESTERS MITSUBISHI RAYON COMPANY LTD. (JP) 1999-10-19 US claimed
EP-0735062-A1 ACTINIC-RADIATION-CURABLE COMPOSITION AND LENS SHEET MITSUBISHI RAYON CO., LTD. (JP) 1996-10-02 EP claimed