SCHEMBL5846246

SCHEMBL5846246

C=C(C)C(=O)OCC(COC(=O)C(=C)C)OC(=O)c1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.48
POLB P06746 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
SERPINE1 P05121 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
CDC25A P30304 1/20 0.37
CDC25B P30305 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTPN2 P17706 1/20 0.36
PTPN11 Q06124 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35

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
SCHEMBL33378 0.97 PTPN1 (0.52) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL7084792 0.90 POLB (0.41) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL15894730 0.87 PTPN1 (0.38) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL10168303 0.85 POLB (0.43) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL14730856 0.85 TSHR (0.45) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL4097168 0.85 TSHR (0.45) PTPN1POLBTDP1SERPINE1APEX1
SCHEMBL1263713 0.85 PTPN1 (0.65) PTPN1POLBTDP1SERPINE1TSHR
SCHEMBL8373670 0.85 ADRB2 (0.41) POLBTDP1APEX1HTTTSHR
SCHEMBL9615565 0.83 ALDH1A1 (0.45) POLBTDP1APEX1HTTTSHR
SCHEMBL7126886 0.83 POLB (0.40) PTPN1POLBTDP1APEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115674-B2 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2006-10-03 US claimed
US-20050049326-A1 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2005-03-03 US claimed
JP-57038749-A None JP disclosed
US-7115674-B2 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2006-10-03 US disclosed
US-20050049326-A1 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2005-03-03 US disclosed
US-5260476-A Dental restoration TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1993-11-09 US disclosed
EP-0266220-B1 CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-01-07 EP disclosed
US-5171763-A A dental composite of a monomer containing poly(3,4-carboxylic benzoic acid and acrylic ester moities, an ion leachable filler and an initiator; high adhesion and strength; discoloration inhibition TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1992-12-15 US disclosed
US-5122061-A Two part composition of acrylate or methacrylate monomers, trialkylboron or oxide thereof; for dental composite resin MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-06-16 US disclosed
EP-0282280-B1 CURABLE ADHESIVE COMPOSITIONS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-05-20 EP disclosed
EP-0323521-B1 CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4985516-A MONOACRYLATE, POLYACRYLATE, ACID ACRYLATE MONOMER, TRIALKYLBORON OR ITS OXIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-01-15 US disclosed
EP-0323521-A1 CURABLE COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-07-12 EP disclosed
EP-0266220-A2 Curable composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-05-04 EP disclosed
JP-S5738749-A 2- 3,4-DICARBOXYBENZOYLOXY -1,3-DIMETHACRYLOYLOXYPROPANE AND ITS PREPARATION KURARAY CO LTD 1982-03-03 JP disclosed