SCHEMBL6240477

SCHEMBL6240477

C=CCOC(=O)Oc1ccccc1S(=O)(=O)c1ccccc1OC(=O)OCC=C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.46
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LIG1 P18858 1/20 0.39
RHOA P61586 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 2/20 0.36
KCNA3 P22001 1/20 0.36
MAPK1 P28482 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTR6 P50406 1/20 0.35
HPGD P15428 1/20 0.35
CA1 P00915 1/20 0.34

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
SCHEMBL299806 0.90 CYP3A4 (0.45) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL5534242 0.88 CYP3A4 (0.44) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL5534231 0.88 CYP3A4 (0.44) CYP3A4TSHRHSD17B10ALDH1A1LIG1
Ammonia Solution, Strong SCHEMBL9637411 0.88 CYP3A4 (0.44) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL5534234 0.87 CYP3A4 (0.43) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL6153776 0.85 CYP3A4 (0.56) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL6241641 0.81 CYP3A4 (0.51) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL9174748 0.78 CYP3A4 (0.49) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL5605874 0.78 CYP3A4 (0.49) CYP3A4TSHRHSD17B10ALDH1A1LIG1
SCHEMBL1598847 0.78 CYP3A4 (0.49) CYP3A4TSHRHSD17B10ALDH1A1LIG1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6911339-B2 Transparent polymer support for organic synthesis DUMAS DAVID P (US) 2005-06-28 US disclosed
EP-1177241-B1 OPTICAL RESIN COMPOSITION COMPRISING THIOL-ENE PREPOLYMER PPG IND OHIO INC (US) 2005-06-22 EP disclosed
US-20040118688-A1 Transparent polymer support for electrophoresis and electrochromatography and related methods DUMAS DAVID P (US) 2004-06-24 US disclosed
US-6669873-B1 Polythiol and unsaturated comonomers including divinylbenzene and/or methacrylic anhydride ; shrinkage inhibition PPC INDUSTRIES OHIO, INC. 2003-12-30 US disclosed
US-20030013188-A1 Transparent polymer support for organic synthesis DUMAS DAVID P (US) 2003-01-16 US disclosed
EP-1044228-B1 PROCESS FOR FORMING POLY(ALLYL CARBONATE)-FUNCTIONAL PREPOLYMER COMPOSITION PPG IND OHIO INC (US) 2002-07-10 EP disclosed
US-6057411-A HEATING ALLYL CARBONATE WITH FREE RADICAL INITIATOR FOR POLYMERIZATION PPG INDUSTRIES OHIO, INC. (US) 2000-05-02 US disclosed
US-4742133-A CONTROLLING TEMPERATURE PPG INDUSTRIES, INC. (US) 1988-05-03 US disclosed
US-4548984-A MOLYBDENUM DIOXYDICHLORIDE AND MOLYBDENUM HEXACARBONYL PPG INDUSTRIES, INC. (US) 1985-10-22 US disclosed