SCHEMBL17715100

SCHEMBL17715100

C=CCO[C@]1(C(=O)OC)C[C@@H](O)[C@@H](NC(C)=O)C(CC(O)CO)O1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 3/20 0.42
▸ MAG P20916 6/20 0.33
▸ SIGLEC7 Q9Y286 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
SCHEMBL16839997 0.82 NANP (0.58) NANPMAGSIGLEC7
SCHEMBL15087687 0.82 NANP (0.58) NANPMAGSIGLEC7
SCHEMBL18357290 0.82 NANP (0.58) NANPMAGSIGLEC7
SCHEMBL18410846 0.80 NANP (0.54) NANPMAGSIGLEC7
SCHEMBL24246810 0.79 NANP (0.41) NANPMAG
SCHEMBL12112837 0.79 NANP (0.41) NANPMAG
SCHEMBL27391404 0.79 NANP (0.41) NANPMAG
SCHEMBL25576480 0.79 NANP (0.41) NANPMAG
SCHEMBL16840021 0.78 NANP (0.58) NANPMAGSIGLEC7
SCHEMBL16373220 0.78 NANP (0.58) NANPMAGSIGLEC7

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-2797946-B1 SIALIC ACID DIMERS BROSSMER REINHARD (DE) 2016-05-04 — — EP disclosed
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