SCHEMBL28274795

SCHEMBL28274795

CCCO[C@@H]1O[C@@H]2COC(C)(C)O[C@H]2[C@H](O)[C@H]1O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ YWHAZ P63104 3/20 0.37
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ TLR2 O60603 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL28276205 0.90 MAPK1 (0.38) YWHAZTLR2
SCHEMBL28276199 0.90 MAPK1 (0.38) YWHAZTLR2
SCHEMBL28274791 0.90 MAPK1 (0.38) YWHAZTLR2
SCHEMBL28274780 0.90 MAPK1 (0.38) YWHAZTLR2
SCHEMBL16882238 0.87 YWHAZ (0.37) YWHAZCA1CA2CA9MEN1
SCHEMBL14330425 0.86 YWHAZ (0.36) YWHAZCA1CA2CA9
SCHEMBL13909435 0.81 YWHAZ (0.36) YWHAZCA1CA2CA9
SCHEMBL4205268 0.81 YWHAZ (0.36) YWHAZCA1CA2CA9
SCHEMBL10889700 0.81 MEN1 (0.45) YWHAZCA1CA2CA9MEN1
SCHEMBL7155153 0.81 MEN1 (0.45) YWHAZCA1CA2CA9MEN1

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-B The preparation method of glucosan derivative cationic-liposome nano particle 湖南师范大学 2019-02-19 — — CN claimed
CN-105585597-B The preparation method of glucosan derivative cationic-liposome nano particle 湖南师范大学 2019-02-19 — — CN disclosed
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