SCHEMBL4423129

SCHEMBL4423129

CCC(C)CCOC(C)C(=O)c1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
MAPT P10636 1/20 0.40
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 3/20 0.34
APEX1 P27695 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
TSHR P16473 1/20 0.34
ACE2 Q9BYF1 2/20 0.33
LMNA P02545 2/20 0.33
ELANE P08246 1/20 0.33
LTB4R Q15722 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL15382607 0.88 ALDH1A1 (0.39) ALDH1A1MAPTCDC25ACDC25BHSD17B10
SCHEMBL14139388 0.88 MAPK1 (0.47) ALDH1A1MAPTCDC25ACDC25BHSD17B10
SCHEMBL10282308 0.87 MAPT (0.36) ALDH1A1MAPTPOLBL3MBTL1TDP1
SCHEMBL13660253 0.85 ALDH1A1 (0.46) ALDH1A1CDC25ACDC25BHSD17B10TSHR
SCHEMBL13660388 0.81 KDM4E (0.51) MAPTPOLBL3MBTL1KDM4E
SCHEMBL14199595 0.79 ALDH1A1 (0.36) ALDH1A1CDC25ACDC25BHSD17B10POLB
SCHEMBL4397767 0.79 ALDH1A1 (0.40) ALDH1A1MAPTCDC25ACDC25BHSD17B10
SCHEMBL15382530 0.77 ALDH1A1 (0.38) ALDH1A1MAPTCDC25ACDC25BHSD17B10
SCHEMBL13660244 0.76 ALDH1A1 (0.38) ALDH1A1MAPTCDC25ACDC25BHSD17B10
SCHEMBL11918211 0.72 ALDH1A1 (0.34) ALDH1A1CDC25ACDC25BHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2662729-A1 Method for preparation of lithographic printing plate Fujifilm Corporation (JP) 2013-11-13 EP disclosed
EP-2447780-A1 Method for preparation of lithographic printing plate Fujifilm Corporation (JP) 2012-05-02 EP disclosed
EP-2107422-A1 Method for preparing lithographic printing plate FUJIFILM Corporation (JP) 2009-10-07 EP disclosed
EP-1947514-A2 Method for preparation of lithographic printing plate FUJIFILM Corporation (JP) 2008-07-23 EP disclosed