SCHEMBL8713937

SCHEMBL8713937

COc1ccc(N2C(=O)c3ccccc3C2OC)cc1OC1Cc2ccccc2C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.47
PDE4A P27815 9/20 0.47
PDE4C Q08493 9/20 0.47
PDE4D Q08499 9/20 0.47
QPCT Q16769 1/20 0.45
RAB9A P51151 1/20 0.41
NR1H3 Q13133 2/20 0.40
NR1H2 P55055 1/20 0.40
HTR2C P28335 1/20 0.38

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
SCHEMBL8713095 0.89 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8711275 0.88 RAB9A (0.57) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8710631 0.88 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8711923 0.87 QPCT (0.52) QPCTRAB9ANR1H3NR1H2
SCHEMBL8710486 0.86 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8707692 0.81 NR1H3 (0.53) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL8712435 0.79 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8712925 0.78 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DQPCT
SCHEMBL8707476 0.76 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DNR1H3
SCHEMBL7696958 0.76 PDE4B (0.49) 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