SCHEMBL12752191

SCHEMBL12752191

C=C(C)C(=O)OCOC(=O)NCNC(=O)OCOC(=O)C(=C)C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 2/20 0.43
THRB P10828 1/20 0.41
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACHE P22303 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
SCHEMBL55860 0.91 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL15677230 0.90 THRB (0.39) TSHRALDH1A1THRB
SCHEMBL12752210 0.88 TSHR (0.36) TSHRALDH1A1THRBTDP1
SCHEMBL11544171 0.86 THRB (0.44) TSHRALDH1A1THRBACHE
SCHEMBL19885344 0.84 THRB (0.55) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL148579 0.82 TSHR (0.58) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL11544013 0.82 TSHR (0.45) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL7759129 0.81 ALDH1A1 (0.52) TSHRALDH1A1THRBPOLBAPEX1
Hydrochloric Acid SCHEMBL14976774 0.80 TSHR (0.56) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL13029376 0.79 ALDH1A1 (0.40) TSHRALDH1A1THRBTDP1ACHE

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
US-8802355-B2 Lithographic printing plate precursor and plate making method thereof FUJIFILM CORPORATION (JP) 2014-08-12 US disclosed
US-20110076621-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PLATE MAKING METHOD THEREOF FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
US-20100248142-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PLATE MAKING METHOD THEREOF FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed