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Sugi Predict / Compounds / SCHEMBL8143379

SCHEMBL8143379

SCHEMBL8143379

CC(=O)N[C@@H]1C[C@@]23Oc4c(c(C(=O)O)cc5c4CNC5=O)C[C@]2(C)[C@@H](C)CC[C@H]3C(C)(C)[C@H]1Cl

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 2/20 0.34
▸ ST3GAL1 Q11201 1/20 0.33
▸ ST3GAL3 Q11203 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
SCHEMBL8143378 1.00 ST6GAL1 (0.34) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8134912 0.93 ST6GAL1 (0.34) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8134915 0.93 ST6GAL1 (0.34) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8140562 0.91 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8140564 0.91 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8146894 0.87 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8146892 0.87 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8142513 0.84 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8142515 0.84 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8142157 0.84 ST6GAL1 (0.47) ST6GAL1ST3GAL1ST3GAL3

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-6143732-A USED AS ANTIVIRAL AGENT AGAINST INFLUENZA VIRUS SHIONOGI & CO., LTD. (JP) 2000-11-07 — — US disclosed
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