SCHEMBL5350503

SCHEMBL5350503

COc1ccc(CC=CC(=O)O)cc1OC1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 0.53
PDE4A P27815 12/20 0.53
PDE4D Q08499 11/20 0.53
PDE4C Q08493 10/20 0.53
POLB P06746 1/20 0.49
MAPK14 Q16539 1/20 0.47

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
SCHEMBL5350500 1.00 PDE4B (0.53) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7332295 0.89 PDE4B (0.53) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7328806 0.89 PDE4B (0.53) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7326065 0.85 RECQL (0.51) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7326058 0.85 RECQL (0.51) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL27919546 0.84 ALDH1A1 (0.61) POLB
SCHEMBL7375826 0.83 PDE4B (0.57) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7361212 0.82 RECQL (0.51) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7325727 0.82 RECQL (0.51) PDE4BPDE4APDE4DPDE4C
SCHEMBL2371289 0.81 PDE4B (0.60) PDE4BPDE4APDE4DPDE4CPOLB

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
US-7169808-B2 Compounds useful for the preparation of medicaments with phosphodiesterase IV inhibitory activity SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-01-30 US claimed