SCHEMBL15538484

SCHEMBL15538484

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COC(=O)CCC(=O)OC[C@H]2O[C@@H](n3cnc4c(O)ncnc43)C(O)C2O)C(O)C1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 2/20 0.66
P2RY1 P47900 4/20 0.65
ADORA1 P30542 3/20 0.65
P2RY2 P41231 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
SRC P12931 2/20 0.65
DNPH1 O43598 1/20 0.65
PRKAB2 O43741 1/20 0.65
TRPM2 O94759 1/20 0.65
LDHA P00338 1/20 0.65
ADRB2 P07550 1/20 0.65
FBP1 P09467 1/20 0.65
PRKAG1 P54619 1/20 0.65
PRKAA2 P54646 1/20 0.65
PDE4D Q08499 1/20 0.65
KCNH2 Q12809 1/20 0.65
PRKAA1 Q13131 1/20 0.65
PDE3A Q14432 1/20 0.65
TAS1R3 Q7RTX0 1/20 0.65
TAS1R1 Q7RTX1 1/20 0.65

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
Adenosine SCHEMBL15538483 0.93 ADORA1 (0.65) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL14178285 0.91 PLA2G2A (0.68) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL2790606 0.91 PLA2G2A (0.68) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL15297005 0.91 PLA2G2A (0.68) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL16945765 0.91 PLA2G2A (0.68) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL1066705 0.90 PRKACA (0.66) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL13869231 0.90 PRKACA (0.69) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL6536155 0.89 PRKACA (0.67) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL10586454 0.89 PRKACA (0.67) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2
SCHEMBL11516619 0.89 AHCY (0.73) PRKACAP2RY1ADORA1P2RY2SMN1; SMN2

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-2013180200-A1 TARGET-TISSUE-SPECIFIC ANTIGEN-BINDING MOLECULE 中外製薬株式会社 (JP) 2013-12-05 WO disclosed