SCHEMBL7878461

SCHEMBL7878461

COc1ccc(Cn2c(=O)c3cc(OCN)ccc3n(C3CCN(C=O)CC3)c2=O)cc1OC

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 10/20 0.82
PDE7B Q9NP56 5/20 0.76
PDE8A O60658 3/20 0.76
MEN1 O00255 3/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TP53 P04637 2/20 0.40
MAPK1 P28482 2/20 0.38
GAA P10253 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
C5AR1 P21730 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
PRKDC P78527 1/20 0.35

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
SCHEMBL30837831 0.92 PDE7A (0.83) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL100713 0.92 PDE7A (0.83) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL99998 0.92 PDE7A (0.88) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL100114 0.90 PDE7A (0.80) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL30837972 0.90 PDE7A (1.00) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL100698 0.90 PDE7A (1.00) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL100608 0.90 PDE7A (1.00) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL30837886 0.90 PDE7A (1.00) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL99985 0.90 PDE7A (0.80) PDE7APDE7BPDE8AMEN1MAPT
SCHEMBL30837824 0.90 PDE7A (0.80) PDE7APDE7BPDE8AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411009-B1 Therapeutic uses of quinazolinedione derivatives SANOFI SA (FR) 2013-03-20 EP disclosed
WO-2010116090-A1 THERAPEUTIC APPLICATIONS IN THE CARDIOVASCULAR FIELD OF QUINAZOLINEDIONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-10-14 WO disclosed
WO-2010109148-A1 THERAPEUTIC USES OF QUINAZOLINEDIONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-09-30 WO disclosed
WO-2009077680-A1 QUINAZOLINEDIONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USES THEREOF SANOFI-AVENTIS (FR) 2009-06-25 WO disclosed