SCHEMBL8156923

SCHEMBL8156923

COC1C[C@@]23Oc4c(cc(Cl)c5c4CNC5=O)C[C@]2(C)[C@@H](C)CC[C@H]3C(C)(C)C1Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ST6GAL1 P15907 1/20 0.31
▸ CETP P11597 2/20 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
SCHEMBL8156927 1.00 ST6GAL1 (0.31) ST6GAL1CETPENTPD5
SCHEMBL8146474 0.91 ST6GAL1 (0.31) ST6GAL1
SCHEMBL8146476 0.91 ST6GAL1 (0.31) ST6GAL1
SCHEMBL8149555 0.88 CETP (0.34) ST6GAL1CETPENTPD5
SCHEMBL8149559 0.88 CETP (0.34) ST6GAL1CETPENTPD5
SCHEMBL8143215 0.85 CETP (0.33) ST6GAL1CETP
SCHEMBL8142383 0.85 ST6GAL1 (0.38) ST6GAL1CETPENTPD5
SCHEMBL8142381 0.85 ST6GAL1 (0.38) ST6GAL1CETPENTPD5
SCHEMBL8143218 0.85 CETP (0.33) ST6GAL1CETP
SCHEMBL8133862 0.84 ST6GAL1 (0.33) 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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