SCHEMBL7150864

SCHEMBL7150864

COc1ccc(C(C)CN/C(=N/C#N)NCC(OC)OC)cc1OC1CCOC1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 12/20 0.52
PDE4D Q08499 15/20 0.51
PDE4A P27815 8/20 0.51
PDE4C Q08493 8/20 0.51
SOS1 Q07889 1/20 0.36

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
SCHEMBL7150876 1.00 PDE4B (0.52) PDE4BPDE4DPDE4APDE4CSOS1
SCHEMBL7145895 0.93 PDE4D (0.47) PDE4BPDE4DPDE4APDE4C
SCHEMBL7145891 0.93 PDE4D (0.47) PDE4BPDE4DPDE4APDE4C
SCHEMBL7146075 0.88 PDE4B (0.49) PDE4BPDE4DPDE4APDE4C
SCHEMBL7146082 0.88 PDE4B (0.49) PDE4BPDE4DPDE4APDE4C
SCHEMBL7150885 0.86 PDE4B (0.52) PDE4BPDE4DPDE4APDE4C
SCHEMBL7143466 0.84 PDE4B (0.51) PDE4BPDE4DPDE4APDE4C
SCHEMBL7143463 0.84 PDE4B (0.51) PDE4BPDE4DPDE4APDE4C
SCHEMBL7151013 0.81 PDE4B (0.49) PDE4BPDE4DPDE4APDE4C
SCHEMBL7151008 0.81 PDE4B (0.49) PDE4BPDE4DPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934280-B1 PDE IV INHIBITING 2-CYANOIMINOIMIDAZOLE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-04-09 EP disclosed