SCHEMBL5368442

SCHEMBL5368442

C=C(C)C(=O)OCC[C](CO)CCOC(=O)C(=C)C

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
TSHR P16473 3/20 0.50
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
EPHX1 P07099 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL7121709 0.83 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8747501 0.82 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL2453478 0.80 THRB (0.57) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9312977 0.80 THRB (0.57) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL10426403 0.80 THRB (0.57) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL587661 0.80 THRB (0.57) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL15636 0.79 THRB (0.74) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL6142874 0.79 THRB (0.74) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL75014 0.78 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL6695792 0.78 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1

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-9605143-B2 Resin composition for formation of optical waveguide, resin film for formation of optical waveguide which comprises the resin composition, and optical waveguide produced using the resin composition or the resin film HITACHI CHEMICALS COMPANY, LTD. (JP) 2017-03-28 US disclosed
US-20130223803-A1 RESIN COMPOSITION FOR FORMATION OF OPTICAL WAVEGUIDE, RESIN FILM FOR FORMATION OF OPTICAL WAVEGUIDE WHICH COMPRISES THE RESIN COMPOSITION, AND OPTICAL WAVEGUIDE PRODUCED USING THE RESIN COMPOSITION OR THE RESIN FILM HITACHI CHEMICAL COMPANY, LTD. (JP) 2013-08-29 US disclosed
WO-2007043570-A1 ACTIVE ENERGY RAY-CURABLE RESIN COMPOSITION FOR FILM PROTECTION LAYER, FILM USING SAME AND OPTICAL SHEET DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-04-19 WO disclosed
EP-0385456-A2 High surface hardness transparent resin and polymerizable monomer MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-09-05 EP disclosed