SCHEMBL7328147

SCHEMBL7328147

COc1ccc([C@](C)(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])NC(=O)OC2CC(C)CCC2C(C)C)cc1OC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 12/20 0.39
PDE5A O76074 1/20 0.38
EPHX1 P07099 2/20 0.38
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDE4B Q07343 3/20 0.35
PDE4A P27815 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL7324386 0.89 SERPINE1 (0.40) SERPINE1PDE5AEPHX1NPSR1L3MBTL1
SCHEMBL7320525 0.83 SERPINE1 (0.42) SERPINE1PDE5AEPHX1PDE4BPDE4A
SCHEMBL7324380 0.81 SERPINE1 (0.40) SERPINE1PDE5AEPHX1NPSR1L3MBTL1
SCHEMBL7326213 0.77 SERPINE1 (0.37) SERPINE1EPHX1PDE4BPDE4APDE4C
SCHEMBL7329516 0.77 SERPINE1 (0.37) SERPINE1EPHX1PDE4BPDE4APDE4C
SCHEMBL7325124 0.76 TRPV1 (0.40) SERPINE1EPHX1PDE4BPDE4APDE4C
SCHEMBL7327388 0.76 TRPV1 (0.40) SERPINE1EPHX1PDE4BPDE4APDE4C
SCHEMBL7322847 0.75 PDE4B (0.45) EPHX1PDE4BPDE4APDE4CPDE4D
SCHEMBL7322794 0.75 PDE4B (0.45) EPHX1PDE4BPDE4APDE4CPDE4D
SCHEMBL7323501 0.72 PDE4B (0.43) EPHX1PDE4BPDE4APDE4CPDE4D

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