SCHEMBL6587190

SCHEMBL6587190

CCC(=O)N1Cc2cc(OC)ccc2C(Cc2c(Cl)cncc2Cl)=N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 1.00
PDE4B Q07343 19/20 1.00
PDE4C Q08493 19/20 1.00
PDE4D Q08499 19/20 1.00
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6588753 0.92 PDE4A (0.85) PDE4APDE4BPDE4CPDE4D
SCHEMBL6587701 0.91 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL6586727 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7508956 0.89 PDE4D (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7509015 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL6591734 0.88 PDE4A (0.78) PDE4APDE4BPDE4CPDE4D
SCHEMBL6589938 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL6592279 0.87 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7506512 0.87 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7508021 0.87 PDE4A (1.00) 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