SCHEMBL6485199

SCHEMBL6485199

COc1ccc(C2=NN(C3CCN(C(=O)C(C)N)CC3)C(=O)[C@@H]3CC=CC[C@H]23)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 18/20 0.71
PDE4B Q07343 13/20 0.71
PDE4A P27815 12/20 0.71
PDE4C Q08493 12/20 0.71
PDE7B Q9NP56 1/20 0.63

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
SCHEMBL6485190 1.00 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL14251169 0.90 PDE4D (0.73) PDE4DPDE4BPDE4APDE4C
Hydrochloric Acid SCHEMBL14250106 0.89 PDE4D (0.71) PDE4DPDE4BPDE4APDE4C
SCHEMBL6479899 0.88 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6479903 0.86 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL2884716 0.86 PDE4D (0.77) PDE4DPDE4BPDE4APDE4C
SCHEMBL4010327 0.86 PDE4D (0.68) PDE4DPDE4BPDE4APDE4C
SCHEMBL5553386 0.85 PDE4D (0.78) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL6489896 0.85 PDE4D (0.61) PDE4DPDE4BPDE4APDE4CPDE7B
SCHEMBL7149898 0.85 PDE4D (0.75) PDE4DPDE4BPDE4APDE4CPDE7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933296-B2 Compounds effective as β2-adrenoreceptor agonists as well as PDE4-inhibitors ALTANA PHARMA B.V. (NL) 2005-08-23 US disclosed
EP-1296956-A1 COMPOUNDS EFFECTIVE AS BETA-2-ADRENORECEPTOR AGONISTS AS WELL AS PDE4-INHIBITORS ALTANA Pharma AG (DE) 2003-04-02 EP disclosed
WO-2001094319-A1 COMPOUNDS EFFECTIVE AS BETA-2-ADRENORECEPTOR AGONISTS AS WELL AS PDE4-INHIBITORS ALTANA PHARMA AG (DE) 2001-12-13 WO disclosed