SCHEMBL1104298

SCHEMBL1104298

CC(CO)(CO)COC(=O)c1ccccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
TSHR P16473 6/20 0.49
ALOX15 P16050 2/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP3A4 P08684 3/20 0.42
MAPK1 P28482 2/20 0.42
TP53 P04637 1/20 0.42
HIF1A Q16665 1/20 0.42
LMNA P02545 1/20 0.41
NPC1 O15118 1/20 0.41
CA2 P00918 1/20 0.40

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
SCHEMBL9107131 0.87 TSHR (0.49) ALDH1A1TSHRTDP1L3MBTL1MEN1
SCHEMBL9723920 0.87 ALDH1A1 (0.54) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL9107142 0.86 ALDH1A1 (0.45) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL10883068 0.85 ALDH1A1 (0.56) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL7633775 0.85 ALDH1A1 (0.59) ALDH1A1TSHRALOX15TDP1L3MBTL1
Ethylene Glycol SCHEMBL23581096 0.84 ALDH1A1 (0.54) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL10539768 0.84 TDP1 (0.56) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL30850212 0.83 ALDH1A1 (0.57) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL28690056 0.83 ALDH1A1 (0.57) ALDH1A1TSHRALOX15TDP1L3MBTL1
SCHEMBL8423222 0.83 ALDH1A1 (0.57) ALDH1A1TSHRALOX15TDP1L3MBTL1

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
US-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed
US-7455954-B2 Lithographic printing plate precursor and polymerizable composition FUJIFILM CORPORATION (JP) 2008-11-25 US disclosed