SCHEMBL838042

SCHEMBL838042

O=c1n(CCCCO)c(=O)n(CCOCCOCCOCCO)c(=O)n1CCOCCOCCOCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 2/20 0.34
MGLL Q99685 1/20 0.34
THRB P10828 1/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RGS12 O14924 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
PABPC1 P11940 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
TK1 P04183 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
SCHEMBL837378 0.93 MEN1 (0.45) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL837376 0.93 MEN1 (0.45) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL1532676 0.88 MEN1 (0.48) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL2032325 0.82 ALDH1A1 (0.43) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL837375 0.81 MEN1 (0.43) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL12123151 0.80 KMT2A (0.40) MEN1KMT2ATSHRMAPK1MGLL
SCHEMBL12123148 0.80 KMT2A (0.40) MEN1KMT2ATSHRMAPK1MGLL
SCHEMBL25465030 0.80 ALDH1A1 (0.42) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL13327050 0.80 ALDH1A1 (0.42) MEN1KMT2ATSHRMAPK1SMN1; SMN2
SCHEMBL398824 0.75 PDE4A (0.42) MEN1KMT2ATSHRSMN1; SMN2HTT

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-8142982-B2 Lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
US-8142978-B2 Planographic printing plate precursor and printing method using the same FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
US-20090111049-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-04-30 US disclosed
US-20080286685-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-11-20 US disclosed