SCHEMBL8143347

SCHEMBL8143347

COC1C[C@@]23Oc4c(cc(C(=O)O)c5c4CNC5=O)C[C@]2(C)[C@@H](C)CC[C@H]3C(C)(C)C1O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 3/20 0.35
▸ ST3GAL1 Q11201 2/20 0.32
▸ ST3GAL3 Q11203 2/20 0.32
▸ FUT6 P51993 1/20 0.31
▸ FUT5 Q11128 1/20 0.31
▸ CETP P11597 1/20 0.31

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
SCHEMBL8143351 1.00 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8148322 0.94 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8140919 0.92 ST6GAL1 (0.32) ST6GAL1ST3GAL1ST3GAL3CETP
SCHEMBL8140917 0.92 ST6GAL1 (0.32) ST6GAL1ST3GAL1ST3GAL3CETP
SCHEMBL8142180 0.89 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8142172 0.89 ST6GAL1 (0.36) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8143332 0.86 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8143334 0.86 ST6GAL1 (0.35) ST6GAL1ST3GAL1ST3GAL3FUT6FUT5
SCHEMBL8146544 0.84 ST6GAL1 (0.32) ST6GAL1ST3GAL1ST3GAL3
SCHEMBL8146547 0.84 ST6GAL1 (0.32) 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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