SCHEMBL6674912

SCHEMBL6674912

N#Cc1c(N)ncn1C1OC(CO)C(O)C1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.57
ADORA2B P29275 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
ADORA3 P0DMS8 2/20 0.57
DPP4 P27487 1/20 0.57
MEN1 O00255 1/20 0.57
SLC28A1 O00337 1/20 0.57
MAP3K7 O43318 1/20 0.57
SLC28A2 O43868 1/20 0.57
GAPDH P04406 1/20 0.57
MAPK1 P28482 1/20 0.57
ADORA1 P30542 1/20 0.57
STAT6 P42226 1/20 0.57
PI4KA P42356 1/20 0.57
KMT2A Q03164 1/20 0.57
PI4K2B Q8TCG2 1/20 0.57
DOT1L Q8TEK3 1/20 0.57
SLC29A1 Q99808 1/20 0.57
PI4K2A Q9BTU6 1/20 0.57
SLC28A3 Q9HAS3 1/20 0.57

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
SCHEMBL5746201 0.85 ADORA3 (0.52) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL11472440 0.82 TP53 (0.62) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL9619994 0.82 TP53 (0.62) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL6934040 0.82 TP53 (0.62) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL30539506 0.81 ADORA3 (0.51) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL9697576 0.80 ADORA3 (0.49) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL9698667 0.78 ADORA3 (0.47) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL9698515 0.78 ADORA3 (0.50) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL9698584 0.77 ADORA3 (0.50) ADORA2AADORA2BSMN1; SMN2ADORA3DPP4
SCHEMBL259432 0.77 ADORA2A (0.74) ADORA2AADORA2BADORA3ADORA1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004037159-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING FAT METABOLISM OBETHERAPY BIOTECHNOLOGY (FR) 2004-05-06 WO disclosed