SCHEMBL7456776

SCHEMBL7456776

CCCNC(=O)Oc1nc(C)ccc1C(=O)Nc1c(Cl)ccc(C)c1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CCNE1 P24864 2/20 0.35
CDK2 P24941 2/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
ITGB7 P26010 1/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD17B10 Q99714 3/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33

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
SCHEMBL7460856 0.88 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL7458253 0.87 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL7680208 0.85 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL6949924 0.84 CCNE1 (0.35) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL7460958 0.83 GAA (0.40) CCNE1CDK2ALDH1A1ITGB1ITGA4
SCHEMBL7461854 0.83 ALDH1A1 (0.41) CCNE1CDK2ALDH1A1LMNAPOLB
SCHEMBL6949794 0.79 HDAC1 (0.36) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL7464085 0.78 PDE4D (0.42) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7683047 0.78 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DCCNE1
SCHEMBL7684169 0.77 ALDH1A1 (0.37) PDE4APDE4BPDE4CPDE4DCCNE1

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
JP-2002540193-A 2002-11-26 JP claimed
EP-1165515-A1 PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES BASF AKTIENGESELLSCHAFT (DE) 2002-01-02 EP claimed
WO-2000058288-A1 PYRIDINE-2,3-DICARBOXYLIC ACID DIAMIDES BASF AKTIENGESELLSCHAFT (DE) 2000-10-05 WO claimed