SCHEMBL30132129

SCHEMBL30132129

[2H]OC(=O)C(O)(C(=O)O)C(O)C(O)CO

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
PDE4A P27815 1/20 0.33
LMNA P02545 1/20 0.31
OR51E2 Q9H255 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
SCHEMBL7534971 0.89 PDE4A (0.39) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL8465616 0.77 PDE4A (0.46) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL9280372 0.72 PDE4A (0.39) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL31224147 0.72 PDE4A (0.39) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL30500524 0.71 USP2 (0.34) USP2SLCO1B1PDE4ALMNA
SCHEMBL28406761 0.70 LMNA (0.33) USP2SLCO1B1PDE4ALMNA
SCHEMBL6753289 0.69 PDE4A (0.41) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL6295932 0.68 TSHR (0.38) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL4280412 0.68 PDE4A (0.37) USP2SLCO1B1PDE4ALMNAOR51E2
SCHEMBL21313126 0.68 CPT2 (0.39) USP2SLCO1B1PDE4ALMNAOR51E2

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-4101521-A1 SEPARATION MEMBRANE AND METAL ORGANIC STRUCTURE NITTO DENKO CORPORATION (JP) 2022-12-14 EP disclosed