SCHEMBL12752001

SCHEMBL12752001

C=CCOCCOCCOC(=O)C(C)(CO)CO

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ALDH1A1 P00352 3/20 0.40
TP53 P04637 3/20 0.40
HIF1A Q16665 3/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL12284015 0.98 TSHR (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2615569 0.86 CYP4F2 (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL29781936 0.84 THRB (0.33) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL12751971 0.83 ALDH1A1 (0.40) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL14219513 0.82 TSHR (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL782365 0.82 TSHR (0.39) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL16664312 0.81 ALDH1A1 (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL6947345 0.81 ALDH1A1 (0.41) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL19263794 0.80 ALDH1A1 (0.35) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL14713388 0.80 ALDH1A1 (0.35) TSHRALDH1A1TP53HIF1AHSD17B10

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 2 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