SCHEMBL821206

SCHEMBL821206

CN(C)/C=C1/C(=O)/C(=C/N(C)C)c2ccccc21

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.79
MAPT P10636 8/20 0.79
SMN1; SMN2 Q16637 3/20 0.79
HTT P42858 3/20 0.79
HIF1A Q16665 1/20 0.79
KDM4E B2RXH2 5/20 0.58
HSD17B10 Q99714 3/20 0.58
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
ALOX15 P16050 1/20 0.53
MAP1LC3B Q9GZQ8 2/20 0.47
RECQL P46063 3/20 0.45
POLB P06746 2/20 0.45
USP2 O75604 1/20 0.45
LMNA P02545 2/20 0.44
CDC25B P30305 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
CES2 O00748 1/20 0.42

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
SCHEMBL30502831 0.88 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL10633841 0.88 ALDH1A1 (1.00) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL13798510 0.87 ALDH1A1 (0.61) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL29979663 0.85 ALDH1A1 (0.92) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL4917923 0.81 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL22230162 0.81 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL4917924 0.81 ALDH1A1 (0.60) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL4502491 0.78 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL4478903 0.78 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HTTHIF1A
SCHEMBL4748361 0.78 MAPT (0.75) ALDH1A1MAPTSMN1; SMN2HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2072570-B1 A lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2014-10-08 EP disclosed
US-8778590-B2 Lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2014-07-15 US disclosed
US-8778590-B2 Lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2014-07-15 US disclosed
US-20110287364-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2011-11-24 US disclosed
US-20110287364-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2011-11-24 US disclosed
WO-2010079020-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2010-07-15 WO disclosed
EP-2072570-A1 A lithographic printing plate precursor Agfa Graphics N.V. (BE) 2009-06-24 EP disclosed