SCHEMBL7367287

SCHEMBL7367287

CC(C)(C)OC(=O)C(Cc1ccc(F)cc1)C(=O)c1cccnc1Oc1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
PDE10A Q9Y233 3/20 0.46
ROCK2 O75116 1/20 0.42
UGCG Q16739 1/20 0.41

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
SCHEMBL27514001 0.95 KMT2A (0.44) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7374580 0.94 KMT2A (0.43) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7405885 0.93 KMT2A (0.45) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7374248 0.88 PDE4A (0.43) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7684071 0.86 MAPK8 (0.49) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7369264 0.83 KMT2A (0.50) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL7367980 0.78 KMT2A (0.54) KMT2APDE4APDE4BPDE4CPDE4D
SCHEMBL16921584 0.76 CTSS (0.49) KMT2A
SCHEMBL6906234 0.76 MAPK8 (0.61) KMT2A
SCHEMBL27535809 0.75 PDE4A (0.41) KMT2APDE4APDE4BPDE4CPDE4D

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