SCHEMBL6585375

SCHEMBL6585375

COc1ccc2c(Cc3c(Cl)cncc3Cl)nncc2c1C#Cc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.72
PDE4B Q07343 20/20 0.72
PDE4C Q08493 20/20 0.72
PDE4D Q08499 20/20 0.72

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
SCHEMBL6586115 0.92 PDE4A (0.64) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587924 0.84 PDE4A (0.70) PDE4APDE4BPDE4CPDE4D
SCHEMBL6586660 0.84 PDE4D (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587081 0.82 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL6588857 0.81 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL6588016 0.81 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587932 0.80 PDE4A (0.45) PDE4APDE4BPDE4CPDE4D
SCHEMBL6585373 0.78 PDE4A (0.63) PDE4APDE4BPDE4CPDE4D
SCHEMBL6592467 0.77 PDE4A (0.61) PDE4APDE4BPDE4CPDE4D
SCHEMBL6586630 0.77 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097142-B1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON SPA (IT) 2004-10-13 EP disclosed
US-6492360-B1 Phthalazine derivatives phosphodiesterase 4 inhibitors ZAMBON GROUP S.P.A. (IT) 2002-12-10 US disclosed
US-6329370-B1 CARDIOVASCULAR DISORDERS AND TUMOR NECROSIS FACTOR (HEREINAFTER TNF.SUB..ALPHA.), A CYTOKINE WITH PRO-INFLAMMATORY ACTIVITY ZAMBON GROUP S.P.A. (IT) 2001-12-11 US disclosed
EP-1097142-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.p.A. (IT) 2001-05-09 EP disclosed
WO-2000005218-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.P.A. (IT) 2000-02-03 WO disclosed