SCHEMBL5264841

SCHEMBL5264841

CCOC(=O)Oc1cc(N)c2nc(C)c(C)n2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.37
KDM4E B2RXH2 4/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP3A4 P08684 3/20 0.35
CYP2C9 P11712 3/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 2/20 0.35
CYP1A2 P05177 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 2/20 0.33
HCRTR1 O43613 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
GABRP O00591 1/20 0.32

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
SCHEMBL5261078 0.87 CYP3A4 (0.34) KDM4ECYP3A4CYP2C9CYP2D6CYP2C19
SCHEMBL4169299 0.79 SMN1; SMN2 (0.44) CA2KDM4EHSD17B10CYP3A4CYP2C9
SCHEMBL6634450 0.76 ALDH1A1 (0.35) KDM4EHSD17B10CYP3A4CYP2C9SMN1; SMN2
SCHEMBL6635042 0.75 CYP3A4 (0.59) CYP3A4CYP2C9CYP2D6CYP2C19CYP1A2
SCHEMBL4163641 0.71 CYP3A4 (0.49) KDM4EHSD17B10CYP3A4CYP2C9CYP2D6
SCHEMBL6353312 0.68 SMN1; SMN2 (0.53) KDM4EHSD17B10CYP3A4CYP1A2SMN1; SMN2
SCHEMBL7014171 0.68 ADORA3 (0.42) KDM4EHSD17B10CYP2D6CYP2C19CYP1A2
SCHEMBL4170737 0.68 CA12 (0.39) CA2KDM4ECYP3A4CYP2C9CYP2D6
SCHEMBL4573822 0.67 CA12 (0.48) CA2KDM4EHSD17B10CYP3A4CYP2C9
SCHEMBL6214346 0.67 SMN1; SMN2 (0.51) KDM4EHSD17B10CYP3A4CYP2C9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1491542-B1 Intermediate compounds for the preparation of imidazo-pyridine-derivatives ASTRAZENECA AB (SE) 2007-09-05 EP claimed
EP-1105391-B1 Imidazo[1,2-a]pyridine compounds that inhibit gastric acid secretion, pharmaceutical compositions thereof, and processes for thier preparation ASTRAZENECA AB (SE) 2004-10-27 EP claimed