SCHEMBL17827241

SCHEMBL17827241

CC[C@H](C)OC(=O)C1(c2nc3c(O)ccc(-c4ccc5c(c4)COC5=O)n3n2)CC1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.82
PDE4A P27815 1/20 0.65
PDE4B Q07343 1/20 0.65
PDE4C Q08493 1/20 0.65

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
SCHEMBL16218321 0.90 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL15071077 0.90 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL15071020 0.79 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL15060342 0.76 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL16218320 0.76 PDE4D (0.86) PDE4DPDE4APDE4BPDE4C
SCHEMBL3469495 0.76 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL508401 0.71 PDE4D (0.79) PDE4DPDE4APDE4BPDE4C
SCHEMBL16435086 0.71 PDE4D (0.73) PDE4DPDE4APDE4BPDE4C
SCHEMBL508408 0.71 PDE4D (0.61) PDE4DPDE4APDE4BPDE4C
SCHEMBL508927 0.71 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C

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
EP-2794603-B1 [1,2,4]TRIAZOLOPYRIDINES AND THEIR USE AS PHOSPODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-06-15 EP disclosed