SCHEMBL6587708

SCHEMBL6587708

CCCNc1nnc(Cc2c(Cl)cncc2Cl)c2ccc(OC)cc12

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 17/20 0.65
PDE4B Q07343 17/20 0.65
PDE4C Q08493 17/20 0.65
PDE4D Q08499 17/20 0.65
KDR P35968 3/20 0.40

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
SCHEMBL6627680 0.85 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DKDR
SCHEMBL6589991 0.84 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL4701651 0.81 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL6589078 0.81 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587900 0.81 PDE4A (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587423 0.79 PDE4A (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL6591087 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL6586166 0.78 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DKDR
SCHEMBL6585568 0.77 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587710 0.77 PDE4A (0.67) 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 3 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