SCHEMBL6523772

SCHEMBL6523772

C=C(C)C(=O)OCCOC(COC(=O)C(=C)C)CC(=C)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
THRB P10828 1/20 0.42
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL844666 0.83 TSHR (0.49) TSHRTHRBALDH1A1
SCHEMBL10355752 0.83 THRB (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11751848 0.81 THRB (0.45) TSHRTHRB
Methacrylic Acid SCHEMBL4055237 0.79 TSHR (0.45) TSHRTHRBALDH1A1
SCHEMBL17075267 0.77 ALDH1A1 (0.56) TSHRTHRBALDH1A1
SCHEMBL28343113 0.76 TSHR (0.52) TSHRTHRBALDH1A1
Acrylic Acid SCHEMBL6259608 0.76 TSHR (0.41) TSHRTHRBALDH1A1
SCHEMBL8162991 0.75 TSHR (0.44) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL7545167 0.75 THRB (0.52) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL2407775 0.75 THRB (0.43) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1088848-B1 Porous materials SHIPLEY CO LLC (US) 2005-12-28 EP disclosed
US-6602804-B2 Dielectric, polymer blend SHIPLEY COMPANY, L.L.C. 2003-08-05 US disclosed
US-20030004218-A1 Porous materials SHIPLEY COMPANY, L.L.C. 2003-01-02 US disclosed
US-6420441-B1 DISPERSING REMOVABLE CROSSLINKED POLYMER POROGENS IN A POLYSILOXANE, CURING, AND HEATING TO REMOVE POROGEN; LOW DIELECTRIC CONSTANT; HIGH POROSITY; INSULATION MATERIALS SHIPLEY COMPANY, L.L.C. 2002-07-16 US disclosed
EP-1088848-A1 Porous materials Shipley Company LLC (US) 2001-04-04 EP disclosed