SCHEMBL8055342

SCHEMBL8055342

BCc1ccc(OC)c(-c2cccc(Cl)c2)n1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.67
PDE4D Q08499 3/20 0.67
CNR2 P34972 1/20 0.47
PGK1 P00558 1/20 0.46
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CTSA P10619 3/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL3795584 0.86 PDE4B (0.67) PDE4BPDE4DCNR2PGK1MAPT
SCHEMBL27595204 0.81 PDE4B (0.60) PDE4BPDE4DCNR2PGK1MAPT
SCHEMBL8062503 0.80 PDE4B (0.65) PDE4BPDE4DSMN1; SMN2CTSA
SCHEMBL3787844 0.80 PDE4B (0.59) PDE4BPDE4DCNR2PGK1MAPT
SCHEMBL3790133 0.76 PDE4B (0.67) PDE4BPDE4D
SCHEMBL14151596 0.74 CNR2 (0.60) PDE4BPDE4DCNR2CTSA
SCHEMBL16044163 0.74 PDE4B (0.63) PDE4BPDE4DCNR2CTSA
SCHEMBL4316685 0.73 PDE4D (0.70) PDE4BPDE4DCNR2CTSA
SCHEMBL15674640 0.72 PDE4B (0.53) PDE4BPDE4DCNR2PGK1MAPT
SCHEMBL8069736 0.71 PDE4B (0.60) PDE4BPDE4DCNR2MAPTNPC1

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-2009067600-A2 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATION DECODE GENETICS EHF (IS) 2009-05-28 WO disclosed