SCHEMBL29087629

SCHEMBL29087629

COc1cn([C@]2(C)O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 7/20 0.38
PYGM P11217 3/20 0.36
TK1 P04183 2/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TK2 O00142 1/20 0.35

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
SCHEMBL28751490 0.88 TK2 (0.36) PYGMTK1LMNASMN1; SMN2TK2
SCHEMBL28305927 0.85 P2RY6 (0.38) P2RY6PYGMTK1LMNASMN1; SMN2
SCHEMBL1825757 0.84 TK1 (0.43) TK1LMNATK2
SCHEMBL26666707 0.84 PYGM (0.38) PYGMTK1LMNASMN1; SMN2TK2
SCHEMBL12658380 0.84 TK1 (0.43) TK1LMNATK2
SCHEMBL6537910 0.83 LMNA (0.46) P2RY6PYGMLMNASMN1; SMN2TK2
SCHEMBL6829243 0.83 PYGM (0.37) PYGMTK1LMNASMN1; SMN2TK2
SCHEMBL28141307 0.83 TYMS (0.38) PYGMTK1LMNATK2
SCHEMBL28326624 0.83 PYGM (0.34) PYGMTK1TK2
SCHEMBL157466 0.83 KDM4E (0.34) PYGMTK2

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
CN-116710108-A Compositions and methods for simultaneous modulation of gene expression 维萨梅布有限公司 2023-09-05 CN disclosed