SCHEMBL6012053

SCHEMBL6012053

C[C@H]1C[C@@H]2CC[C@@H](C(N)=O)N2C1=O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.30
F2 P00734 1/20 0.30
PLG P00747 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
SCHEMBL6033115 0.74 XIAP (0.37) XIAPF2PLG
SCHEMBL6033714 0.74 XIAP (0.37) XIAPF2PLG
SCHEMBL6033718 0.74 XIAP (0.37) XIAPF2PLG
SCHEMBL6033112 0.74 XIAP (0.37) XIAPF2PLG
SCHEMBL15468310 0.74 CA1 (0.32)
SCHEMBL12033678 0.71 XIAP (0.32) XIAPF2PLG
SCHEMBL12033659 0.71 XIAP (0.32) XIAPF2PLG
SCHEMBL16104161 0.71 XIAP (0.36) XIAPF2PLG
SCHEMBL9609009 0.71 F2 (0.36) XIAPF2PLG
SCHEMBL30547064 0.71 CAPN1 (0.33)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651649-A1 NOVEL CYANOPYRROLIDIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICAMENTS Sanofi-Aventis Deutschland GmbH (DE) 2006-05-03 EP disclosed
WO-2005012308-A1 NOVEL CYANOPYRROLIDIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE OF THE SAME AS MEDICAMENTS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-02-10 WO disclosed