SCHEMBL25818680

SCHEMBL25818680

CC(C)(C)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)CC1OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
ENPP1 P22413 2/20 0.48
P2RY1 P47900 2/20 0.48
ADORA1 P30542 3/20 0.48
ADA P00813 1/20 0.46
TP53 P04637 1/20 0.45
CYP2C9 P11712 1/20 0.45
NFKB1 P19838 1/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
APEX1 P27695 1/20 0.45
PI4KA P42356 1/20 0.45
BLM P54132 1/20 0.45
KMT2A Q03164 1/20 0.45
ADCY1 Q08828 1/20 0.45
PI4K2B Q8TCG2 1/20 0.45
PI4K2A Q9BTU6 1/20 0.45
PI4KB Q9UBF8 1/20 0.45

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
SCHEMBL23645538 0.92 POLB (0.49) POLBENPP1P2RY1ADORA1ADA
SCHEMBL19887008 0.89 POLB (0.47) POLBENPP1P2RY1ADORA1ADA
SCHEMBL15280844 0.89 POLB (0.47) POLBENPP1P2RY1ADORA1ADA
SCHEMBL24473715 0.88 P2RY1 (0.60) POLBENPP1P2RY1ADORA1DNPH1
SCHEMBL22060000 0.87 POLB (0.46) POLBENPP1P2RY1ADATP53
SCHEMBL12340917 0.84 POLB (0.53) POLBENPP1P2RY1ADORA1DNPH1
SCHEMBL18314959 0.82 ADA (0.53) POLBENPP1P2RY1ADORA1ADA
SCHEMBL22143020 0.82 ADA (0.53) POLBENPP1P2RY1ADORA1ADA
SCHEMBL18314960 0.82 POLB (0.49) POLBENPP1P2RY1ADORA1ADA
SCHEMBL22393564 0.81 POLB (0.52) POLBENPP1P2RY1ADORA1ADA

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
US-20230212572-A1 Guanosine Analogues for Use in Therapeutics Polynucleotides ROCHE INNOVATION CENTER COPENHAGEN A/S (DK) 2023-07-06 US disclosed
US-20230212572-A1 Guanosine Analogues for Use in Therapeutics Polynucleotides ROCHE INNOVATION CENTER COPENHAGEN A/S (DK) 2023-07-06 US disclosed