SCHEMBL1104172

SCHEMBL1104172

CCC(C)(C)C(=O)Nc1cc(C(=O)OC)cc(C(=O)OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.58
LMNA P02545 2/20 0.56
ALDH1A1 P00352 5/20 0.55
HSD17B10 Q99714 2/20 0.55
MAPT P10636 3/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HTT P42858 2/20 0.48
HPGD P15428 2/20 0.48
XBP1 P17861 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PTPN11 Q06124 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.45
BLM P54132 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
RECQL P46063 1/20 0.44
POLB P06746 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
PRSS1 P07477 1/20 0.43
TMPRSS15 P98073 1/20 0.43

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
SCHEMBL1104180 0.85 ALDH1A1 (0.60) ALDH1A1MAPTMEN1KMT2AHTT
SCHEMBL751079 0.84 MEN1 (0.60) KDM4ELMNAALDH1A1MAPTMEN1
SCHEMBL1948564 0.82 CNR2 (0.50) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL1950254 0.78 L3MBTL1 (0.55) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL1948064 0.78 L3MBTL1 (0.55) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL18172338 0.76 NOTUM (0.53) KDM4ELMNAALDH1A1HSD17B10MAPT
SCHEMBL1948578 0.76 KMT2A (0.51) LMNAMAPTMEN1KMT2A
SCHEMBL1104140 0.76 ALDH1A1 (0.42) KDM4ELMNAALDH1A1HSD17B10MAPT
SCHEMBL12226380 0.75 L3MBTL1 (0.61) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL23160973 0.75 HTT (0.47) LMNAALDH1A1MAPTMEN1KMT2A

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
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-7507525-B2 Polymerizable composition and lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2009-03-24 US disclosed
US-7279539-B2 Alkali-soluble polymer and polymerizable composition thereof FUJIFILM CORPORATION (JP) 2007-10-09 US disclosed