SCHEMBL6572980

SCHEMBL6572980

CCCCS(=O)(=O)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](c2nnc(C(C)(C)C)o2)[C@@H](O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 1/20 0.51
P2RX3 P56373 1/20 0.46
P2RX2 Q9UBL9 1/20 0.46
ADORA3 P0DMS8 8/20 0.46
ADORA1 P30542 7/20 0.46
ADORA2A P29274 5/20 0.46
ADORA2B P29275 4/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
DOT1L Q8TEK3 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
SCHEMBL6572835 0.94 ADORA3 (0.48) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6575215 0.89 ADORA1 (0.46) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6575222 0.89 ADORA1 (0.46) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6574580 0.88 ADORA3 (0.47) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6574576 0.88 ADORA3 (0.47) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6574592 0.85 ADORA3 (0.47) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6574589 0.85 ADORA3 (0.47) SLC29A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6575179 0.82 ADORA3 (0.42) ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6575172 0.82 ADORA3 (0.42) ADORA3ADORA1ADORA2AADORA2B
SCHEMBL6573870 0.77 ADORA3 (0.60) SLC29A1ADORA3ADORA1ADORA2AADORA2B

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-1090019-B1 ADENOSINE DERIVATIVES GLAXO GROUP LTD (GB) 2004-09-29 EP disclosed
EP-1447407-A1 Adenosine derivatives GLAXO GROUP LIMITED (GB) 2004-08-18 EP disclosed