SCHEMBL7323406

SCHEMBL7323406

CCOC(=O)NC(C)(NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC2CCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 9/20 0.43
PDE4A P27815 5/20 0.43
PDE4C Q08493 5/20 0.43
PDE4D Q08499 5/20 0.43
PDE5A O76074 1/20 0.43
ALDH1A1 P00352 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX2 P34913 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL7327414 0.89 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL7327539 0.87 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DEPHX2
SCHEMBL7321848 0.86 POLB (0.44) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL7320525 0.82 SERPINE1 (0.42) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL7323403 0.76 PDE4A (0.43) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL7324386 0.73 SERPINE1 (0.40) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL9272449 0.72 ALDH1A1 (0.57) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL7327409 0.72 PDE4A (0.42) PDE4BPDE4APDE4CPDE4DPDE5A
SCHEMBL7327388 0.71 TRPV1 (0.40) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL7325124 0.71 TRPV1 (0.40) PDE4BPDE4APDE4CPDE4DALDH1A1

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
EP-0557408-A4 IMIDAZOLIDINONE COMPOUNDS 1993-10-27 EP disclosed
EP-0557408-A1 IMIDAZOLIDINONE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1993-09-01 EP disclosed
WO-1992007567-A1 IMIDAZOLIDINONE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1992-05-14 WO disclosed