SCHEMBL8465685

SCHEMBL8465685

COC(=O)c1ccc(-c2ccc(OC)c(OC3CCCC3)c2)cc1C(=O)OC

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 13/20 0.65
PDE4D Q08499 13/20 0.65
PDE4B Q07343 12/20 0.65
PDE4C Q08493 12/20 0.65
PDE5A O76074 1/20 0.57
POLB P06746 1/20 0.57
MKNK1 Q9BUB5 1/20 0.50
MKNK2 Q9HBH9 1/20 0.50

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
SCHEMBL8465687 0.94 PDE4A (0.68) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL7375824 0.90 PDE4A (0.62) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8461881 0.86 PDE4A (0.79) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8466183 0.86 PDE4A (0.74) PDE4APDE4DPDE4BPDE4CPOLB
SCHEMBL5823060 0.83 PDE4A (0.77) PDE4APDE4DPDE4BPDE4CPOLB
SCHEMBL8206531 0.82 PDE4A (0.80) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL4600365 0.82 PDE4A (0.72) PDE4APDE4DPDE4BPDE4CPOLB
SCHEMBL8684271 0.81 PDE4A (0.57) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL5309884 0.80 PDE4D (0.67) PDE4APDE4DPDE4BPDE4CPDE5A
SCHEMBL8885266 0.79 PDE4B (0.81) PDE4APDE4DPDE4BPDE4CPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745063-B1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PROD (US) 1999-03-24 EP disclosed
US-5691376-A ANTIHISTAMINE, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-11-25 US disclosed
US-5650444-A BRONCHODILATOR AGENTS, ANTIALLERGENS AND ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-07-22 US disclosed