SCHEMBL7700341

SCHEMBL7700341

COc1ccc(N2C(=O)c3cc(CN4Cc5cnc(O)cc5C4=O)ccc3C2C)cc1OC1CCCC1.COc1ccc(N2C(=O)c3cc(CN4Cc5cnccc5C4=O)ccc3C2C)cc1OC1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.38
PDE4A P27815 14/20 0.38
PDE4D Q08499 14/20 0.38
PDE4C Q08493 11/20 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
SCHEMBL7703620 0.88 PDE4A (0.39) PDE4BPDE4APDE4DPDE4C
SCHEMBL7698210 0.86 PDE4B (0.43) PDE4BPDE4APDE4DPDE4C
SCHEMBL7700051 0.86 PDE4B (0.41) PDE4BPDE4APDE4DPDE4C
SCHEMBL7697107 0.85 PDE4B (0.40) PDE4BPDE4APDE4DPDE4C
SCHEMBL7694640 0.84 PDE4B (0.41) PDE4BPDE4APDE4DPDE4C
SCHEMBL7688309 0.83 PDE4A (0.45) PDE4BPDE4APDE4DPDE4C
SCHEMBL7692942 0.81 PDE4A (0.48) PDE4BPDE4APDE4DPDE4C
SCHEMBL7700449 0.81 PDE4D (0.43) PDE4BPDE4APDE4DPDE4C
SCHEMBL7700346 0.80 NR1H2 (0.35) PDE4BPDE4APDE4DPDE4C
SCHEMBL7696101 0.77 PDE4A (0.40) 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-2002081446-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOINDOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG CO., LTD. (KR) 2002-10-17 WO disclosed