SCHEMBL8149539

SCHEMBL8149539

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

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 1/20 0.31
▸ CETP P11597 1/20 0.30
▸ ENTPD5 O75356 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
SCHEMBL8149532 1.00 ST6GAL1 (0.31) ST6GAL1CETPENTPD5
SCHEMBL8134744 0.91 ST6GAL1 (0.33) ST6GAL1CETPENTPD5
SCHEMBL8134738 0.91 ST6GAL1 (0.33) ST6GAL1CETPENTPD5
SCHEMBL8146266 0.87 ST6GAL1 (0.33) ST6GAL1CETPENTPD5
SCHEMBL8146267 0.87 ST6GAL1 (0.33) ST6GAL1CETPENTPD5
SCHEMBL8143381 0.86 CETP (0.33) ST6GAL1CETPENTPD5
SCHEMBL8143387 0.86 CETP (0.33) ST6GAL1CETPENTPD5
SCHEMBL8147772 0.85 — —
SCHEMBL8141885 0.85 CETP (0.34) ST6GAL1CETPENTPD5
SCHEMBL8141881 0.85 CETP (0.34) ST6GAL1CETPENTPD5

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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