SCHEMBL7754870

SCHEMBL7754870

C[C@H]1O[C@H](N)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FUCA1 P04066 6/20 0.45
▸ CA2 P00918 6/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ CA12 O43570 1/20 0.42
▸ GBA1 P04062 4/20 0.33
▸ CA1 P00915 5/20 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
SCHEMBL9543062 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL18805935 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL3406853 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL23665084 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL19770394 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL23665088 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL1527010 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL7753936 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL22779020 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1
SCHEMBL17679207 1.00 FUCA1 (0.45) FUCA1CA2CA9CA12GBA1

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
WO-2001055157-A1 N-SUBSTITUTED DERIVATIVES OF 4-AMINO-4,6-DIDESOXY-α-D-GLUCOPYRANOSYL-(1→4)-α-D-GLUCOPYRANOSYL-(1→4)-D-GLUCOPYRANOSE AND 4-AMINO-4,6-DIDESOXY-α-D-GLUCOPYRANOSYL-(1→4)-α-D-GLUCOPYRANOSYL-(1→4)-β-D-GLUCOPYRANOSIDE AND PREPARATION METHOD CHIRALSEP (FR) 2001-08-02 — — WO claimed
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