SCHEMBL7542303

SCHEMBL7542303

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c(OC2C(=O)C3C=CC2C3)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.48
PDE4D Q08499 14/20 0.46
PDE4B Q07343 17/20 0.44
PDE4A P27815 12/20 0.44
PDE4C Q08493 12/20 0.44

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
SCHEMBL7985943 0.84 PDE4D (0.64) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL15532207 0.79 PDE4B (0.69) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL9526223 0.78 PDE4B (0.68) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL7474586 0.70 PDE4B (0.50) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL7425561 0.70 PDE4B (0.50) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL7985937 0.70 PDE4B (0.35) PDE4DPDE4BPDE4APDE4C
SCHEMBL7417915 0.70 PDE4B (0.52) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL7107092 0.69 PDE4D (0.39) PDE4DPDE4BPDE4APDE4C
SCHEMBL5083406 0.67 PDE4D (0.45) GFERPDE4DPDE4BPDE4APDE4C
SCHEMBL30614148 0.66 PDE4D (0.68) PDE4DPDE4BPDE4APDE4C

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
US-5935978-A Compounds containing phenyl linked to aryl or heteroaryl by an aliphatic- or heteroatom-containing linking group RHONE-POULENC RORER LIMITED (GB) 1999-08-10 US claimed
US-5935978-A Compounds containing phenyl linked to aryl or heteroaryl by an aliphatic- or heteroatom-containing linking group RHONE-POULENC RORER LIMITED (GB) 1999-08-10 US disclosed
US-5840724-A COMPOUNDS FOR TUMOR NECROSIS FACTOR OR ENZYME INHIBITORS OF PHOSPHODIESTERASES RHONE-POULENC RORER LIMITED (GB) 1998-11-24 US disclosed
US-5698711-A INHIBITORS OF TUMOR NECROSIS FACTOR, CYCLIC ADENOSINE-3*,5*-MONOPHOSPHATE PHOSPHODIESTERASE AND EOSINOPHILS RHONE-POULENC RORER LIMITED (GB) 1997-12-16 US disclosed
US-5679696-A FOR INHIBITING TUMOR NECROSIS FACTOR; ENZYME INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1997-10-21 US disclosed