SCHEMBL7909095

SCHEMBL7909095

COc1ccc(C(Cc2ccc(NC(=O)O)cc2)c2ccccc2)cc1OC1CCCC1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 0.77
PDE4D Q08499 2/20 0.68
PDE4B Q07343 1/20 0.68
PDE4C Q08493 1/20 0.68

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
SCHEMBL7911121 0.90 PDE4A (0.72) PDE4APDE4DPDE4BPDE4C
SCHEMBL7907449 0.90 PDE4A (0.85) PDE4APDE4DPDE4BPDE4C
SCHEMBL7911022 0.87 PDE4A (0.85) PDE4APDE4DPDE4BPDE4C
SCHEMBL14578975 0.86 PDE4A (1.00) PDE4APDE4DPDE4BPDE4C
SCHEMBL7907596 0.86 PDE4A (0.86) PDE4APDE4DPDE4BPDE4C
Water SCHEMBL7908948 0.86 PDE4A (0.98) PDE4APDE4DPDE4BPDE4C
SCHEMBL8925092 0.86 PDE4A (0.85) PDE4APDE4DPDE4BPDE4C
SCHEMBL7364913 0.84 PDE4A (0.87) PDE4APDE4DPDE4BPDE4C
SCHEMBL7914509 0.84 PDE4A (0.77) PDE4APDE4DPDE4BPDE4C
SCHEMBL6755456 0.84 PDE4A (0.83) PDE4APDE4DPDE4BPDE4C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626939-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2001-11-07 EP disclosed
US-5622977-A ANTIINFLAMMATORY AGENT, ANTIALLERGENS CELLTECH THERAPEUTICS LIMITED (GB) 1997-04-22 US disclosed