SCHEMBL8324282

SCHEMBL8324282

CNC(=O)CC(c1ccc(OC(F)F)c(OCC2CC2)c1)N1C(=O)c2cccc(NC(C)=O)c2C1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.57
PDE4C Q08493 15/20 0.57
PDE4D Q08499 10/20 0.57
PDE4A P27815 9/20 0.57
HTR2B P41595 1/20 0.52
TNF P01375 3/20 0.49

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
SCHEMBL1143560 0.92 PDE4B (0.58) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1144002 0.92 PDE4B (0.69) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1144312 0.90 PDE4B (0.58) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1144026 0.84 PDE4B (0.70) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1144131 0.82 PDE4B (0.62) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1143589 0.82 PDE4B (0.72) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL21494522 0.81 PDE4B (0.73) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1143705 0.81 PDE4B (0.84) PDE4BPDE4CPDE4DPDE4AHTR2B
SCHEMBL1143730 0.81 TNF (0.51) PDE4BPDE4CPDE4DPDE4ATNF
SCHEMBL1143995 0.81 PDE4B (0.70) PDE4BPDE4CPDE4DPDE4AHTR2B

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-2004060313-A2 FLUOROALKOXY-SUBSTITUTED 1, 3-DIHYDRO-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORPORATION (US) 2004-07-22 WO disclosed