SCHEMBL8633792

SCHEMBL8633792

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2nccnc12.COc1ccc(C(=O)O)c2nccnc12

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.69
PDE4A P27815 18/20 0.69
PDE4B Q07343 18/20 0.69
PDE4C Q08493 18/20 0.69
PDE11A Q9HCR9 1/20 0.56
GFER P55789 1/20 0.55

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
SCHEMBL6963861 0.95 PDE4D (0.75) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL155477 0.82 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL6956136 0.80 TDP1 (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL8269400 0.78 PDE4D (0.64) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL6953997 0.77 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL4698780 0.75 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552602 0.74 PDE4D (0.84) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552658 0.74 PDE4D (0.70) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL4699038 0.74 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL6957668 0.74 FGFR3 (0.53) PDE4DPDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944616-A1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-09-29 EP disclosed
WO-1998022460-A1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1998-05-28 WO disclosed