SCHEMBL7367201

SCHEMBL7367201

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc3c(c2)OCO3)c(F)c1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.73
PDE4B Q07343 1/20 0.73
PDE4C Q08493 1/20 0.73
PDE4D Q08499 1/20 0.73
TSHR P16473 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPK8 P45983 4/20 0.46
POLB P06746 2/20 0.45

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
SCHEMBL5355096 0.92 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL5365102 0.91 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL5362716 0.88 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL5392744 0.88 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL5392741 0.88 PDE4A (0.80) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL6610662 0.88 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL5390493 0.87 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL5398348 0.87 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL7370389 0.87 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL5398363 0.85 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DTSHR

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
US-6380218-B1 FOR THERAPY OF RESPIRATORY, ALLERGIC, AND INFLAMMATORY DISORDERS COMPRISING ASTHMA, CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ACUTE RESPIRATORY DISEASE SYNDROME, PULMONARY HYPERSENSITIVITY, AND ALLERGIC RHINITIS IN A MAMMAL PFIZER INC 2002-04-30 US disclosed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP disclosed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO disclosed