SCHEMBL6909200

SCHEMBL6909200

Nc1nc(C2CC2)nc2c1nnn2C[C@H]1CN(c2ncccn2)CCO1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 20/20 0.77
PDE8A O60658 3/20 0.50

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
SCHEMBL6909220 1.00 PDE8B (0.77) PDE8BPDE8A
SCHEMBL6910428 0.87 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6909917 0.86 PDE8B (0.66) PDE8BPDE8A
SCHEMBL6909224 0.84 PDE8B (0.72) PDE8BPDE8A
SCHEMBL6909564 0.81 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6910604 0.80 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6911420 0.78 PDE8B (0.83) PDE8BPDE8A
SCHEMBL6911029 0.77 PDE8B (0.81) PDE8BPDE8A
SCHEMBL6910920 0.73 PDE8B (0.77) PDE8BPDE8A
SCHEMBL6911364 0.73 PDE8B (0.71) PDE8BPDE8A

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
WO-2011058478-A1 SUBSTITUTED TRIAZOLOPYRIMIDINES AS PDE8 INHIBITORS PFIZER INC. (US) 2011-05-19 WO disclosed