SCHEMBL25416868

SCHEMBL25416868

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

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SELL P14151 3/20 0.44
▸ SELP P16109 3/20 0.44
▸ SELE P16581 3/20 0.44
▸ GAA P10253 1/20 0.44
▸ CD209 Q9NNX6 1/20 0.41
▸ CETP P11597 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ SYNJ2 O15056 1/20 0.40

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
SCHEMBL12338088 0.87 ALDH1A1 (0.46) SELLSELPSELEGAA
SCHEMBL14477411 0.87 ALDH1A1 (0.46) SELLSELPSELEGAA
SCHEMBL19090844 0.82 SELE (0.50) SELLSELPSELEGAACETP
SCHEMBL19090953 0.81 GAA (0.49) GAACETP
SCHEMBL19080623 0.80 GAA (0.48) SELLSELPSELEGAACETP
SCHEMBL27416375 0.80 GAA (0.48) SELLSELPSELEGAACETP
SCHEMBL3725416 0.79 CD209 (0.47) GAACD209CETPMAOBSYNJ2
SCHEMBL10683430 0.79 CD209 (0.47) GAACD209CETPMAOBSYNJ2
SCHEMBL23895569 0.79 CD209 (0.47) GAACD209CETPMAOBSYNJ2
SCHEMBL18647302 0.79 CD209 (0.47) GAACD209CETPMAOBSYNJ2

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-2023091441-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES COMPRISING A TETRA-VALENT SUGAR CLUSTER FOR TREATMENT OF DIABETES MERCK SHARP & DOHME LLC (US) 2023-05-25 — — WO disclosed
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