SCHEMBL30381206

SCHEMBL30381206

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nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 12/20 0.43
▸ PYGL P06737 3/20 0.39
▸ PYGM P11217 2/20 0.39
▸ GAA P10253 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
SCHEMBL11505360 0.80 PYGB (0.52) PYGBPYGLPYGM
SCHEMBL29406981 0.80 PYGB (0.49) PYGBPYGLPYGMGAA
SCHEMBL1674154 0.80 PYGB (0.49) PYGBPYGLPYGMGAA
SCHEMBL28379664 0.80 PYGB (0.49) PYGBPYGLPYGMGAA
SCHEMBL15284881 0.80 PYGB (0.49) PYGBPYGLPYGMGAA
SCHEMBL29484208 0.80 PYGB (0.49) PYGBPYGLPYGMGAA
SCHEMBL28360430 0.77 EPHX2 (0.43) PYGB
SCHEMBL28364090 0.77 EPHX2 (0.43) PYGB
SCHEMBL28891560 0.77 EPHX2 (0.43) PYGB
SCHEMBL7052003 0.71 PYGB (0.47) PYGBPYGLPYGM

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-2023051684-A1 BACTERIAL CAPSULAR OLIGOSACCHARIDE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF 北京大学 2023-04-06 — — WO disclosed
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