SCHEMBL7417915

SCHEMBL7417915

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c(C(=O)C2CCCC2)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.52
PDE4D Q08499 6/20 0.51
PDE4A P27815 5/20 0.51
PDE4C Q08493 5/20 0.51
GFER P55789 1/20 0.50
TYK2 P29597 1/20 0.46

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
SCHEMBL15532207 0.82 PDE4B (0.69) PDE4BPDE4DPDE4APDE4CGFER
SCHEMBL9526223 0.81 PDE4B (0.68) PDE4BPDE4DPDE4APDE4CGFER
SCHEMBL7417912 0.80 PDE4D (0.69) PDE4BPDE4DPDE4APDE4CGFER
SCHEMBL14477305 0.77 KDM2B (0.50) TYK2
SCHEMBL7474586 0.77 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CGFER
SCHEMBL7425561 0.77 PDE4B (0.50) PDE4BPDE4DPDE4APDE4CGFER
SCHEMBL7423445 0.74 KDM2B (0.50)
SCHEMBL4839335 0.72 KDM2B (0.50)
SCHEMBL30614148 0.72 PDE4D (0.68) PDE4BPDE4DPDE4APDE4C
SCHEMBL5083406 0.71 PDE4D (0.45) PDE4BPDE4DPDE4APDE4CGFER

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-1995004046-A1 COMPOUNDS AS PDE IV AND TNF INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-02-09 WO disclosed