SCHEMBL8143360

SCHEMBL8143360

COc1cc2c(c3c1C(=O)NC3)O[C@@]13C[C@@H](O)[C@H](O)C(C)(C)[C@@H]1CC[C@H](C)[C@@]3(C)C2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 3/20 0.42
▸ CETP P11597 2/20 0.38
▸ ST3GAL1 Q11201 2/20 0.34
▸ ST3GAL3 Q11203 2/20 0.34
▸ FUT6 P51993 1/20 0.33
▸ FUT5 Q11128 1/20 0.33
▸ ENTPD5 O75356 1/20 0.31
▸ OSBP P22059 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30

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
SCHEMBL8143357 1.00 ST6GAL1 (0.42) ST6GAL1CETPST3GAL1ST3GAL3FUT6
SCHEMBL8148047 0.87 CETP (0.35) ST6GAL1CETPST3GAL1ST3GAL3
SCHEMBL8148050 0.87 CETP (0.35) ST6GAL1CETPST3GAL1ST3GAL3
SCHEMBL8146466 0.84 CETP (0.35) ST6GAL1CETP
SCHEMBL8146464 0.84 CETP (0.35) ST6GAL1CETP
SCHEMBL8143143 0.83 ST6GAL1 (0.37) ST6GAL1CETPST3GAL1ST3GAL3FUT6
SCHEMBL8143147 0.83 ST6GAL1 (0.37) ST6GAL1CETPST3GAL1ST3GAL3FUT6
SCHEMBL8139540 0.81 ST6GAL1 (0.41) ST6GAL1CETPST3GAL1ST3GAL3FUT6
SCHEMBL8139537 0.81 ST6GAL1 (0.41) ST6GAL1CETPST3GAL1ST3GAL3FUT6
SCHEMBL8143351 0.80 ST6GAL1 (0.35) ST6GAL1CETPST3GAL1ST3GAL3FUT6

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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