SCHEMBL7370768

SCHEMBL7370768

CCC(O)(CC)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)s1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 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
SCHEMBL7367147 0.82 MAPK8 (0.55) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7375869 0.79 PDE4A (0.61) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7371215 0.78 MAPK8 (0.52) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7369907 0.78 MAPK8 (0.52) MAPK8
SCHEMBL7317640 0.78 MAPK8 (0.75) MAPK8KMT2A
SCHEMBL7371487 0.77 MAPK8 (0.51) MAPK8GAA
SCHEMBL7372538 0.77 MAPK8 (0.53) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7372569 0.77 MAPK8 (0.56) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL7368205 0.76 MAPK8 (0.54) MAPK8PDE4APDE4BPDE4CPDE4D
SCHEMBL3086802 0.76 MAPK8 (0.62) MAPK8KMT2A

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-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
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN 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