SCHEMBL8709797

SCHEMBL8709797

COc1ccc(N2C(=O)c3ccccc3C2F)cc1OC1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.49
PDE4A P27815 14/20 0.49
PDE4D Q08499 13/20 0.49
PDE4C Q08493 12/20 0.49
QPCT Q16769 1/20 0.48

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
SCHEMBL7696958 0.89 PDE4B (0.49) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL8710631 0.89 PDE4B (0.49) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL7694104 0.88 RAB9A (0.58) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL8710488 0.87 PDE4B (0.50) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL8713912 0.87 RAB9A (0.57) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL8714317 0.84 PDE4A (0.48) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL7688170 0.81 PDE4B (0.57) PDE4BPDE4APDE4DPDE4C
SCHEMBL8713399 0.80 PDE4B (0.56) PDE4BPDE4APDE4DPDE4C
SCHEMBL8707675 0.79 PDE4B (0.46) PDE4BPDE4APDE4DPDE4CQPCT
SCHEMBL8707836 0.78 PDE4A (0.45) PDE4BPDE4APDE4DPDE4C

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-1998042666-A1 NOVEL 3,4-DIALKOXYPHENYL DERIVATIVES AND THE USE THEREOF DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 1998-10-01 WO disclosed