SCHEMBL29495147

SCHEMBL29495147

NP(O)OC[C@H]1O[C@@H](n2cc(I)c(=O)[nH]c2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PYGM P11217 3/20 0.67
P2RY6 Q15077 7/20 0.64
P2RY14 Q15391 4/20 0.64
DNPH1 O43598 1/20 0.51
NT5E P21589 1/20 0.48
TK2 O00142 2/20 0.48
TK1 P04183 1/20 0.46
P2RY2 P41231 1/20 0.46

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
SCHEMBL21551997 0.90 PYGM (0.55) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL21551984 0.88 PYGM (0.53) PYGMP2RY6P2RY14DNPH1TK2
SCHEMBL7152602 0.86 PYGM (0.67) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL5315376 0.86 DNPH1 (0.51) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL6839765 0.84 PYGM (0.82) PYGMP2RY6P2RY14DNPH1TK2
SCHEMBL27778954 0.84 P2RY6 (0.48) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL1756171 0.82 P2RY6 (0.80) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL16672164 0.82 P2RY6 (0.80) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL12018429 0.82 P2RY6 (0.80) PYGMP2RY6P2RY14DNPH1NT5E
SCHEMBL10132974 0.82 P2RY6 (0.80) PYGMP2RY6P2RY14DNPH1NT5E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3983077-A1 DELIVERY OF OLIGONUCLEOTIDES TO THE STRIATUM Alnylam Pharmaceuticals, Inc. (US) 2022-04-20 EP disclosed