SCHEMBL5797004

SCHEMBL5797004

COc1c(C=O)ccc(OC(F)F)c1OCC1CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.44
PDE4D Q08499 9/20 0.44
PDE4A P27815 6/20 0.44
PDE4C Q08493 5/20 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
SCHEMBL5797239 0.79 PDE4D (0.49) PDE4BPDE4DPDE4APDE4C
SCHEMBL30735868 0.76 PDE4B (0.42) PDE4BPDE4DPDE4APDE4C
SCHEMBL7421344 0.76 CA1 (0.36) PDE4BPDE4DPDE4APDE4C
SCHEMBL5793632 0.76 KDM4E (0.47) PDE4BPDE4DPDE4APDE4C
SCHEMBL20455985 0.75 PDE4D (0.40) PDE4BPDE4DPDE4APDE4C
SCHEMBL28167810 0.74 CA1 (0.40) PDE4B
SCHEMBL20456502 0.74 ERN1 (0.42) PDE4BPDE4DPDE4APDE4C
SCHEMBL4402862 0.73 PDE4B (0.46) PDE4BPDE4DPDE4APDE4C
SCHEMBL636252 0.73 SRC (0.51) PDE4BPDE4DPDE4APDE4C
SCHEMBL5796942 0.73 CA1 (0.46)

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-2006040645-A1 N-(3,5-DICHLOROPYRIDIN-4-YL)-2,4,5-ALKOXY AND 2,3,4-ALKOXY BENZAMIDE DERIVATIVES AS PDE-IV (PHOPHODIESTERASE TYPE-IV) INHIBITORS FOR THE TREATMENT OF INFLAMMATORY DISEASES SUCH AS ASTHMA RANBAXY LABORATORIES LIMITED (IN) 2006-04-20 WO disclosed