SCHEMBL6887251

SCHEMBL6887251

O=c1nc(N[C@@H]2O[C@H](CO)[C@H](Br)[C@H]2O)c(C=CI)c[nH]1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.35
ADK P55263 1/20 0.32
TSHR P16473 1/20 0.31
TK2 O00142 2/20 0.30

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
SCHEMBL6880579 0.93 TK2 (0.37) GSK3BADKTSHRTK2
SCHEMBL6886434 0.91 HDAC1 (0.35) GSK3BADKTSHR
SCHEMBL6885503 0.90 GSK3B (0.43) GSK3BADKTSHR
SCHEMBL6886433 0.90 GSK3B (0.37) GSK3BADK
SCHEMBL6888982 0.89 GSK3B (0.33) GSK3BADK
SCHEMBL6886373 0.87 GSK3B (0.36) GSK3BADKTSHR
SCHEMBL6886915 0.84 GSK3B (0.43) GSK3BADKTSHRTK2
SCHEMBL6888278 0.84 GSK3B (0.38) GSK3BADKTSHR
SCHEMBL6888305 0.82 GSK3B (0.38) GSK3BADKTSHR
SCHEMBL6882003 0.82 GSK3B (0.38) GSK3BADKTSHR

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-1411954-A2 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION Pharmasset Limited (BB) 2004-04-28 EP disclosed
WO-2002032920-A2 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION PHARMASSET LIMITED (BB) 2002-04-25 WO disclosed