SCHEMBL28066822

SCHEMBL28066822

CCCCCCCCCCCCO[C@@H]1[C@@H](OCCCCCCCCCCCC)[C@H](O)O[C@@H]2COC(C)(C)O[C@@H]12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 6/20 0.41
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ TNF P01375 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ THPO P40225 1/20 0.32
▸ GSTA2 P09210 2/20 0.32
▸ GSTP1 P09211 2/20 0.32
▸ GSTM1 P09488 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL28066867 1.00 GBA1 (0.41) GBA1CA1CA2CA9TNF
SCHEMBL4199815 0.84 TLR4 (0.38) —
SCHEMBL4201783 0.83 GBA1 (0.35) GBA1CA1CA2CA9TNF
SCHEMBL12600389 0.81 GBA1 (0.37) GBA1CA1CA2CA9
SCHEMBL28274780 0.80 MAPK1 (0.38) GBA1TNF
SCHEMBL28276205 0.80 MAPK1 (0.38) GBA1TNF
SCHEMBL28274791 0.80 MAPK1 (0.38) GBA1TNF
SCHEMBL28276199 0.80 MAPK1 (0.38) GBA1TNF
SCHEMBL4201778 0.79 GBA1 (0.31) GBA1TNF
SCHEMBL4198168 0.79 GBA1 (0.36) GBA1TNF

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
CN-105585597-A Glucose derivative cation liposome nanoparticle preparation method UNIV HUNAN NORMAL 2016-05-18 — — CN claimed
CN-105585597-A Glucose derivative cation liposome nanoparticle preparation method UNIV HUNAN NORMAL 2016-05-18 — — CN disclosed
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