SCHEMBL8133862

SCHEMBL8133862

C[C@H]1CC[C@H]2C(C)(C)[C@H]3O[C@@H]3C[C@]23Oc2c(cc(Cl)c4c2CNC4=O)C[C@]13C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 2/20 0.33
▸ CETP P11597 1/20 0.31
▸ ENTPD5 O75356 1/20 0.31
▸ ST3GAL1 Q11201 1/20 0.31
▸ ST3GAL3 Q11203 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
SCHEMBL8134286 0.90 ST6GAL1 (0.38) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8134285 0.90 ST6GAL1 (0.38) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8142381 0.86 ST6GAL1 (0.38) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8142383 0.86 ST6GAL1 (0.38) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8142858 0.85 ST6GAL1 (0.37) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8143143 0.85 ST6GAL1 (0.37) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8143147 0.85 ST6GAL1 (0.37) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8149555 0.85 CETP (0.34) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8142855 0.85 ST6GAL1 (0.37) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3
SCHEMBL8149559 0.85 CETP (0.34) ST6GAL1CETPENTPD5ST3GAL1ST3GAL3

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
Send feedback