SCHEMBL6021782

SCHEMBL6021782

COc1ccc(C2=NOC(C)(C(=O)N3CCC(c4ccccc4)CC3)C2)cc1OC1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.65
PDE4A P27815 7/20 0.65
PDE4C Q08493 7/20 0.65
PDE4D Q08499 7/20 0.65

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
SCHEMBL3541858 0.90 PDE4B (0.73) PDE4BPDE4APDE4CPDE4D
SCHEMBL3545499 0.90 PDE4B (0.69) PDE4BPDE4APDE4CPDE4D
SCHEMBL3551823 0.89 PDE4B (0.72) PDE4BPDE4APDE4CPDE4D
SCHEMBL3549971 0.89 PDE4B (0.72) PDE4BPDE4APDE4CPDE4D
SCHEMBL3549439 0.89 PDE4B (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL6021779 0.89 PDE4B (0.64) PDE4BPDE4APDE4CPDE4D
SCHEMBL3544326 0.88 PDE4B (0.69) PDE4BPDE4APDE4CPDE4D
SCHEMBL3548361 0.87 PDE4B (0.68) PDE4BPDE4APDE4CPDE4D
SCHEMBL3552151 0.87 PDE4B (0.68) PDE4BPDE4APDE4CPDE4D
SCHEMBL3552313 0.87 PDE4B (0.61) PDE4BPDE4APDE4CPDE4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663999-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES, LTD. (IN) 2006-06-07 EP disclosed
WO-2005021515-A2 INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED (IN) 2005-03-10 WO disclosed