SCHEMBL5744376

SCHEMBL5744376

CCN(CC)ONC(=O)c1ccc2oc3c(OC)ccc(C(=O)Nc4c(Cl)cncc4Cl)c3c2c1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 17/20 0.57
PDE4B Q07343 15/20 0.57
PDE4A P27815 14/20 0.57
PDE4C Q08493 14/20 0.57
CYP2B6 P20813 1/20 0.44
GFER P55789 1/20 0.43

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
SCHEMBL5748805 0.89 PDE4D (0.60) PDE4DPDE4BPDE4APDE4CCYP2B6
SCHEMBL5745696 0.87 PDE4D (0.59) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5746211 0.86 PDE4D (0.56) PDE4DPDE4BPDE4APDE4CCYP2B6
SCHEMBL5748872 0.86 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5746003 0.85 PDE4D (0.56) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5745772 0.85 PDE4D (0.59) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5748239 0.84 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CCYP2B6
SCHEMBL4028281 0.83 PDE4D (0.63) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5023369 0.83 PDE4D (0.66) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL4026016 0.82 PDE4D (0.59) PDE4DPDE4BPDE4APDE4CGFER

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-1620429-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Glenmark Pharmaceuticals S.A. (CH) 2006-02-01 EP claimed
WO-2004089940-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (US) 2004-10-21 WO claimed
EP-1620429-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Glenmark Pharmaceuticals S.A. (CH) 2006-02-01 EP disclosed
WO-2004089940-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (US) 2004-10-21 WO disclosed