SCHEMBL6910604

SCHEMBL6910604

Nc1nc(C2CC2)nc2c1nnn2C[C@H]1CN(Cc2nccs2)CCO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 20/20 1.00
PDE8A O60658 3/20 0.78

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
SCHEMBL6910585 0.88 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6909572 0.88 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6910428 0.86 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6911014 0.85 PDE8B (1.00) PDE8BPDE8A
SCHEMBL17545207 0.85 PDE8B (1.00) PDE8BPDE8A
SCHEMBL29446195 0.85 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6909564 0.82 PDE8B (1.00) PDE8BPDE8A
SCHEMBL6911420 0.81 PDE8B (0.83) PDE8BPDE8A
SCHEMBL6909220 0.80 PDE8B (0.77) PDE8BPDE8A
SCHEMBL6909200 0.80 PDE8B (0.77) 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