SCHEMBL7316932

SCHEMBL7316932

CC(C)OC(=O)CN1Cc2cccc(OCCCC(=O)N(C3CCCCC3)C3CCCCC3)c2N=C1N

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.60
PDE4B Q07343 20/20 0.60
PDE4C Q08493 20/20 0.60
PDE4D Q08499 20/20 0.60

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
SCHEMBL7314492 0.89 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7305463 0.87 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7306753 0.84 PDE4A (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL10669769 0.84 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311910 0.84 PDE4A (0.45) PDE4APDE4BPDE4CPDE4D
SCHEMBL7314402 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4D
SCHEMBL10665336 0.83 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7314566 0.83 PDE4A (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL10648771 0.82 PDE4A (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL10648568 0.81 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D

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-4761416-A ENZYME INHIBITORS, INOTROPIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-02 US disclosed
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed
EP-0254327-A2 N-N-disubstituted-omega-(2-amino-3-(carbonylmethyl)-3,4-dihydroquinazolinyl) oxyalkylamides and related compounds SYNTEX (U.S.A.) INC. (US) 1988-01-27 EP disclosed