SCHEMBL11878956

SCHEMBL11878956

CNC(=O)N[C@@H]1[C@@H](O)[C@@H](OC)O[C@H](CO)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 8/20 0.51
▸ PYGB P11216 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ CA1 P00915 1/20 0.43
▸ LGALS3 P17931 4/20 0.42
▸ LGALS7; LGALS7B P47929 2/20 0.42
▸ LGALS1 P09382 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ LGALS9 O00182 1/20 0.40
▸ MGAM O43451 2/20 0.40
▸ SI P14410 2/20 0.40
▸ MAPK1 P28482 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
SCHEMBL11881524 1.00 LGALS8 (0.51) LGALS8PYGBCA2CA9CA1
SCHEMBL11881545 1.00 LGALS8 (0.51) LGALS8PYGBCA2CA9CA1
SCHEMBL11878972 1.00 LGALS8 (0.51) LGALS8PYGBCA2CA9CA1
SCHEMBL19392067 0.85 ALDH1A1 (0.56) LGALS8PYGBLGALS3LGALS7; LGALS7BLGALS1
SCHEMBL11777332 0.85 ALDH1A1 (0.56) LGALS8PYGBLGALS3LGALS7; LGALS7BLGALS1
SCHEMBL11777325 0.85 ALDH1A1 (0.56) LGALS8PYGBLGALS3LGALS7; LGALS7BLGALS1
SCHEMBL19309367 0.85 ALDH1A1 (0.56) LGALS8PYGBLGALS3LGALS7; LGALS7BLGALS1
SCHEMBL17523725 0.80 LGALS3 (0.41) LGALS8PYGBLGALS3LGALS7; LGALS7BLGALS1
SCHEMBL11576393 0.77 ALDH1A1 (0.48) LGALS8PYGBCA2CA9CA1
SCHEMBL11576386 0.77 ALDH1A1 (0.48) LGALS8PYGBCA2CA9CA1

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
US-3940383-A ANTICANCER STANFORD RESEARCH INSTITUTE (US) 1976-02-24 — — US disclosed
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