SCHEMBL7368548

SCHEMBL7368548

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)c(C#N)c2)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 4/20 0.51
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
SLC22A12 Q96S37 1/20 0.45
LMNA P02545 1/20 0.42

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
SCHEMBL7370941 0.93 PDE4A (0.51) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7367759 0.90 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7366157 0.88 MAPK8 (0.51) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7684087 0.87 MAPK8 (0.60) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7369625 0.86 MAPK8 (0.55) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7370703 0.83 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7371219 0.83 MAPK8 (0.54) MAPK8
SCHEMBL7368193 0.83 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7365167 0.81 MAPK8 (0.59) MAPK8
SCHEMBL4826727 0.81 MAPK8 (0.54) MAPK8PDE4APDE4BPDE4CPDE4D

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