SCHEMBL27737655

SCHEMBL27737655

CC(C)COC(=O)[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 4/20 0.43
▸ AHCY P23526 1/20 0.42
▸ PYGB P11216 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ PRKD3 O94806 1/20 0.35
▸ PRKCG P05129 1/20 0.35
▸ PRKCB P05771 1/20 0.35
▸ PRKCA P17252 1/20 0.35
▸ PRKCH P24723 1/20 0.35
▸ PRKCI P41743 1/20 0.35
▸ PRKCE Q02156 1/20 0.35
▸ PRKCQ Q04759 1/20 0.35
▸ PRKCZ Q05513 1/20 0.35
▸ PRKCD Q05655 1/20 0.35
▸ PRKD1 Q15139 1/20 0.35
▸ TSHR P16473 2/20 0.33
▸ LGALS9 O00182 1/20 0.33

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
SCHEMBL21943698 0.83 AHCY (0.44) LGALS3AHCYALDH1A1PRKD3PRKCG
SCHEMBL27737603 0.81 LGALS3 (0.46) LGALS3PYGBALDH1A1THRBMAPK1
SCHEMBL20856392 0.76 LGALS3 (0.66) LGALS3PYGBGAALGALS9LGALS8
SCHEMBL20856393 0.76 LGALS3 (0.66) LGALS3PYGBGAALGALS9LGALS8
SCHEMBL8645789 0.72 LGALS3 (0.60) LGALS3PYGBALDH1A1THRBGAA
SCHEMBL9217509 0.71 PYGB (0.44) LGALS3PYGBGAATSHRLGALS9
SCHEMBL1627174 0.71 PYGB (0.44) LGALS3PYGBGAATSHRLGALS9
SCHEMBL28677194 0.71 LGALS3 (0.40) LGALS3PYGBGAAPRKD3PRKCG
SCHEMBL9436540 0.70 PPARG (0.39) LGALS3ALDH1A1MAPK1GAA
SCHEMBL12827977 0.70 PYGB (0.47) LGALS3PYGBGAATSHRLGALS9

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-101402619-A Novel 2-deoxidizedfructofuranose derivative, preparation method and medical uses thereof UNIV CHINA PHARMA (CN) 2009-04-08 — — CN claimed
CN-101402619-A Novel 2-deoxidizedfructofuranose derivative, preparation method and medical uses thereof UNIV CHINA PHARMA (CN) 2009-04-08 — — CN disclosed
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