SCHEMBL830282

SCHEMBL830282

C=CCn1c(=O)[nH]c(=O)n(CCO)c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.54
APEX1 P27695 1/20 0.47
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 2/20 0.42
ADORA2B P29275 4/20 0.40
ADORA3 P0DMS8 1/20 0.40
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
ADORA2A P29274 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL157928 0.86 CYP3A4 (0.71) CYP3A4APEX1NPSR1GAAADORA2B
SCHEMBL838140 0.86 APEX1 (0.59) CYP3A4APEX1ADORA3KMT2ASMN1; SMN2
SCHEMBL9418370 0.84 CYP3A4 (0.70) CYP3A4NPSR1GAAADORA2BKMT2A
SCHEMBL11008643 0.84 CYP3A4 (0.70) CYP3A4NPSR1GAAADORA2BKMT2A
SCHEMBL11077876 0.84 CYP3A4 (0.68) CYP3A4APEX1NPSR1GAAADORA2B
SCHEMBL1560781 0.81 CYP3A4 (0.54) CYP3A4APEX1NPSR1ADORA2BADORA3
SCHEMBL11361357 0.80 CYP3A4 (0.57) CYP3A4APEX1NPSR1GAAADORA2B
SCHEMBL10486046 0.77 HTT (0.49) CYP3A4APEX1NPSR1GAAADORA2B
SCHEMBL13661089 0.77 CYP3A4 (0.58) CYP3A4NPSR1GAAADORA2BADORA3
SCHEMBL1247960 0.77 CYP3A4 (0.52) CYP3A4NPSR1GAAADORA2BADORA3

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-8142978-B2 Planographic printing plate precursor and printing method using the same FUJIFILM CORPORATION (JP) 2012-03-27 US disclosed
EP-1992482-B1 Planographic printing plate precursor and printing method using the same FUJIFILM CORP (JP) 2011-07-20 EP disclosed
US-20080286685-A1 PLANOGRAPHIC PRINTING PLATE PRECURSOR AND PRINTING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-11-20 US disclosed
EP-1992482-A2 Planographic printing plate precursor and printing method using the same FUJIFILM Corporation (JP) 2008-11-19 EP disclosed