SCHEMBL8710488

SCHEMBL8710488

COc1ccc(N2C(=O)c3ccccc3C2C2CC2)cc1OC1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.50
PDE4A P27815 16/20 0.50
PDE4C Q08493 14/20 0.50
PDE4D Q08499 14/20 0.50
QPCT Q16769 1/20 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
SCHEMBL8708895 0.91 QPCT (0.48) QPCT
SCHEMBL8710486 0.89 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8707671 0.88 RAB9A (0.42) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8708151 0.87 PDE4D (0.43) PDE4BPDE4APDE4CPDE4D
SCHEMBL8710631 0.87 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL7696958 0.87 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8709797 0.87 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8711394 0.86 PDE4B (0.45) PDE4BPDE4APDE4CPDE4D
SCHEMBL8711377 0.86 PDE4A (0.44) PDE4BPDE4APDE4CPDE4D
SCHEMBL7694104 0.86 RAB9A (0.58) PDE4BPDE4APDE4CPDE4DQPCT

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