SCHEMBL6879951

SCHEMBL6879951

CS(=O)(=O)O[C@@H]1[C@@H](O)[C@H](Nc2nc(Cl)nc3nc[nH]c23)O[C@@H]1CO

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.42
▸ TNNI3K Q59H18 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ GSK3B P49841 1/20 0.36
▸ TMIGD3 P0DMS9 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ PAX8 Q06710 1/20 0.32

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
SCHEMBL6886938 0.84 XDH (0.48) XDHSMN1; SMN2GSK3BTMIGD3HTR2C
SCHEMBL6885088 0.75 GSK3B (0.36) GSK3B
SCHEMBL6884989 0.75 GSK3B (0.36) GSK3B
SCHEMBL6885551 0.74 GSK3B (0.36) GSK3B
SCHEMBL6887384 0.74 GSK3B (0.36) GSK3B
SCHEMBL3877450 0.73 ADK (0.43) GSK3BPAX8
SCHEMBL2873813 0.73 ADK (0.43) GSK3BPAX8
SCHEMBL6884015 0.72 GSK3B (0.35) GSK3B
SCHEMBL6885692 0.72 ALDH1A1 (0.38) GSK3B
SCHEMBL6882294 0.72 GSK3B (0.34) GSK3B

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
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