SCHEMBL15074820

SCHEMBL15074820

CC(=O)NC1C(O)CC(OCC2OC(C)C(N)C(O)C2O)(C(=O)O)OC1[C@H](O)[C@H](O)CO

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAG P20916 5/20 0.53
▸ SELL P14151 1/20 0.52
▸ SELP P16109 1/20 0.52
▸ SIGLEC7 Q9Y286 2/20 0.52
▸ NANP Q8TBE9 1/20 0.49
▸ CD22 P20273 11/20 0.48

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
SCHEMBL12694418 1.00 MAG (0.53) MAGSELLSELPSIGLEC7NANP
SCHEMBL14628033 0.92 SELL (0.54) MAGSELLSELPSIGLEC7NANP
SCHEMBL13449385 0.92 SELL (0.60) MAGSELLSELPSIGLEC7NANP
SCHEMBL18732825 0.92 SELL (0.60) MAGSELLSELPSIGLEC7NANP
SCHEMBL29410578 0.89 SIGLEC7 (0.55) MAGSELLSELPSIGLEC7NANP
SCHEMBL31309218 0.89 SIGLEC7 (0.57) MAGSELLSELPSIGLEC7NANP
SCHEMBL16298815 0.89 SIGLEC7 (0.55) MAGSELLSELPSIGLEC7NANP
SCHEMBL29437858 0.89 SIGLEC7 (0.57) MAGSELLSELPSIGLEC7NANP
SCHEMBL29397098 0.89 SIGLEC7 (0.57) MAGSELLSELPSIGLEC7NANP
SCHEMBL15177450 0.89 SIGLEC7 (0.55) MAGSELLSELPSIGLEC7NANP

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-2012116225-A9 MUC1 BASED GLYCOLIPOPEPTIDE VACCINE WITH ADJUVANT ONCOTHYREON INC. (US) 2013-06-27 — — WO disclosed
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