SCHEMBL7688307

SCHEMBL7688307

COc1ccc(N2C(=O)c3cc(C(=O)N4Cc5ccccc5C4)ccc3C2C)cc1OC1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.53
PDE4D Q08499 12/20 0.53
PDE4A P27815 5/20 0.46
PDE4C Q08493 5/20 0.46
PDE5A O76074 1/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE1C Q14123 1/20 0.43

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
SCHEMBL7694638 0.92 PDE4B (0.52) PDE4BPDE4DPDE4APDE4C
SCHEMBL7696895 0.83 PDE4B (0.55) PDE4BPDE4DPDE4APDE4C
SCHEMBL7698605 0.81 PDE4B (0.42) PDE4BPDE4DPDE4APDE4C
SCHEMBL7696958 0.81 PDE4B (0.49) PDE4BPDE4DPDE4APDE4C
SCHEMBL7696868 0.80 PDE4B (0.46) PDE4BPDE4DPDE4APDE4C
SCHEMBL8707072 0.79 PDE4B (0.46) PDE4BPDE4DPDE4APDE4C
SCHEMBL7698977 0.78 PDE4B (0.42) PDE4BPDE4DPDE4APDE4C
SCHEMBL7691850 0.78 PDE4B (0.46) PDE4BPDE4DPDE4APDE4C
SCHEMBL7688309 0.78 PDE4A (0.45) PDE4BPDE4DPDE4APDE4C
SCHEMBL8709867 0.77 PDE4A (0.43) 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
WO-2002081446-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOINDOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG CO., LTD. (KR) 2002-10-17 WO disclosed