SCHEMBL8203884

SCHEMBL8203884

COc1cccc(-c2ccc(OC)c(OC3CCCC3)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.67
PDE4D Q08499 8/20 0.67
PDE4B Q07343 5/20 0.67
PDE4C Q08493 5/20 0.67
FPR2 P25090 3/20 0.59

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
SCHEMBL5823060 0.88 PDE4A (0.77) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL7696540 0.87 PDE4A (0.72) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL8461658 0.86 PDE4D (0.71) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL8466532 0.86 PDE4D (0.67) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL8462846 0.85 PDE4A (0.66) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL6798284 0.84 PDE4A (0.65) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL27521810 0.83 PDE4A (0.60) PDE4APDE4DPDE4BPDE4C
SCHEMBL8576613 0.83 PDE4A (0.62) PDE4APDE4DPDE4BPDE4CFPR2
SCHEMBL8477546 0.83 PDE4A (0.62) PDE4APDE4DPDE4BPDE4C
SCHEMBL4602161 0.82 PDE4D (0.62) PDE4APDE4DPDE4BPDE4CFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080790-A SELECTIVE AND POTENT INHIBITORS OF PHOSPHODIESTERASE IV AND ARE USEFUL FOR THE PROPHYLAXIS AND TREATMENT OF INFLAMMATORY DISEASES AND THE ALLEVIATION OF CONDITIONS ASSOCIATED WITH CENTRAL NERVOUS MALFUNCTION CELLTECH THERAPEUTICS, LIMITED (GB) 2000-06-27 US disclosed
EP-0618889-B1 TRI-SUBSTITUTED PHENYL DERIVATIVES AND PROCESSES FOR THEIR PREPARATION CELLTECH THERAPEUTICS LTD (GB) 1998-12-30 EP disclosed
US-5674880-A ANTIINFLAMMATORY AGENT CELLTECH THERAPEUTICS LIMITED (GB) 1997-10-07 US disclosed
US-5491147-A PHOSPHODIESTERASE IV INHIBITORS CELLTECH, LIMITED (GB) 1996-02-13 US disclosed