Sugi Predict

Sugi Predict / Compounds / SCHEMBL3968348

SCHEMBL3968348

SCHEMBL3968348

C=C(Br)c1cn([C@]2(OC)O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PYGM P11217 3/20 0.35
▸ TK2 O00142 3/20 0.33
▸ TK1 P04183 2/20 0.31
▸ LMNA P02545 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL28361568 0.83 TK1 (0.41) TK2TK1LMNA
SCHEMBL3968330 0.82 PYGM (0.37) PYGMTK2TK1LMNASMN1; SMN2
SCHEMBL3973110 0.81 PYGM (0.37) PYGMTK2TK1LMNASMN1; SMN2
SCHEMBL3978670 0.81 PYGM (0.37) PYGMTK2TK1LMNASMN1; SMN2
SCHEMBL3079827 0.80 PYGM (0.34) PYGMTK2TK1LMNASMN1; SMN2
SCHEMBL27791482 0.77 TK1 (0.40) TK2TK1LMNA
SCHEMBL2635503 0.75 SLC28A1 (0.46) —
SCHEMBL3977864 0.75 RNASE1 (0.35) PYGMTK2
SCHEMBL31439434 0.73 P2RY6 (0.39) PYGM
SCHEMBL3087451 0.73 LMNA (0.37) PYGMTK2TK1LMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2054406-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESprotect GmbH (DE) 2009-05-06 — — EP disclosed
WO-2008017515-A1 NUCLEOSIDES FOR SUPPRESSING OR REDUCING THE DEVELOPMENT OF RESISTANCE IN CYTOSTATIC THERAPY RESPROTECT GMBH (DE) 2008-02-14 — — WO disclosed