Sugi Predict

Sugi Predict / Compounds / SCHEMBL8459208

SCHEMBL8459208

SCHEMBL8459208

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

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NANP Q8TBE9 1/20 0.43
▸ CD22 P20273 16/20 0.42
▸ MAG P20916 3/20 0.42

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
SCHEMBL5534696 0.92 NANP (0.51) NANPCD22MAG
SCHEMBL10699657 0.89 NANP (0.52) NANPCD22MAG
SCHEMBL30363521 0.86 L3MBTL1 (0.51) NANPCD22MAG
SCHEMBL6046353 0.86 L3MBTL1 (0.51) NANPCD22MAG
SCHEMBL13410079 0.86 L3MBTL1 (0.51) NANPCD22MAG
SCHEMBL28733264 0.86 L3MBTL1 (0.51) NANPCD22MAG
SCHEMBL442944 0.80 NANP (0.61) NANPCD22MAG
SCHEMBL15321632 0.78 NANP (0.61) NANPCD22MAG
SCHEMBL13191009 0.77 NANP (0.46) NANPCD22MAG
SCHEMBL6046354 0.77 NANP (0.46) NANPCD22MAG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839042-A4 BACTERIAL INHIBITION WITH AN OLIGOSACCHARIDE COMPOUND NEOSE TECHNOLOGIES INC (US) 1999-04-07 — — EP disclosed
EP-0839042-A1 BACTERIAL INHIBITION WITH AN OLIGOSACCHARIDE COMPOUND Neose Technologies, Inc. (US) 1998-05-06 — — EP disclosed
WO-1996040169-A1 BACTERIAL INHIBITION WITH AN OLIGOSACCHARIDE COMPOUND NEOSE TECHNOLOGIES, INC. (US) 1996-12-19 — — WO disclosed