SCHEMBL8263103

SCHEMBL8263103

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2c3c(n(Cc4ccccc4)c12)CCNC3

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.49
PDE4A P27815 18/20 0.49
PDE4B Q07343 18/20 0.49
PDE4C Q08493 18/20 0.49
GFER P55789 1/20 0.41

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
SCHEMBL8264832 0.89 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL8263537 0.86 PDE4D (0.52) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL84871 0.85 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL84870 0.85 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL3873066 0.85 PDE4D (0.47) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL7130963 0.82 PDE4D (0.48) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL74892 0.81 HDAC1 (0.46) PDE4DPDE4APDE4BPDE4C
SCHEMBL5025240 0.80 PDE4D (0.53) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL5022391 0.77 PDE4D (0.50) PDE4DPDE4APDE4BPDE4CGFER
SCHEMBL7122581 0.75 PDE4B (0.53) PDE4DPDE4APDE4BPDE4CGFER

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-2006064355-A2 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS GLENMARK PHARMACEUTICALS S.A. (US) 2006-06-22 WO disclosed