SCHEMBL27560587

SCHEMBL27560587

C=C(C)C(=O)OC(C)(CC)C(OCCCC)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.33
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 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
SCHEMBL27527922 0.84 THRB (0.37) TSHRALDH1A1THRB
SCHEMBL17727598 0.81 TSHR (0.41) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL18704822 0.80 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL28826316 0.75 TSHR (0.37) TSHRTHRB
SCHEMBL2403299 0.74 TSHR (0.42) TSHRALDH1A1THRBTDP1
SCHEMBL23493957 0.72 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL3419173 0.72 TSHR (0.49) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL21712456 0.71 TSHR (0.42) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL9305347 0.71 TSHR (0.66) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL29184229 0.71 TSHR (0.47) TSHRALDH1A1THRBPOLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1451668-A Controllable/active free radical polymerization method, polymer, controlling agent and preparing process thereof UNIV SUZHOU (CN) 2003-10-29 CN claimed
CN-1215087-C Controllable/active free radical polymerization method, polymer, controlling agent and preparing process thereof UNIV SUZHOU (CN) 2005-08-17 CN disclosed
CN-1451668-A Controllable/active free radical polymerization method, polymer, controlling agent and preparing process thereof UNIV SUZHOU (CN) 2003-10-29 CN disclosed