SCHEMBL8134896

SCHEMBL8134896

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

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 2/20 0.35
▸ ENTPD5 O75356 1/20 0.35
▸ ST6GAL1 P15907 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
SCHEMBL8134899 1.00 CETP (0.35) CETPENTPD5ST6GAL1
SCHEMBL8143338 0.89 CETP (0.37) CETPENTPD5ST6GAL1
SCHEMBL8143340 0.89 CETP (0.37) CETPENTPD5ST6GAL1
SCHEMBL8149555 0.88 CETP (0.34) CETPENTPD5ST6GAL1
SCHEMBL8149559 0.88 CETP (0.34) CETPENTPD5ST6GAL1
SCHEMBL8147906 0.87 CETP (0.34) CETPENTPD5ST6GAL1
SCHEMBL8147910 0.87 CETP (0.34) CETPENTPD5ST6GAL1
SCHEMBL8142381 0.83 ST6GAL1 (0.38) CETPENTPD5ST6GAL1
SCHEMBL8142383 0.83 ST6GAL1 (0.38) CETPENTPD5ST6GAL1
SCHEMBL8133862 0.83 ST6GAL1 (0.33) CETPENTPD5ST6GAL1

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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