SCHEMBL7373312

SCHEMBL7373312

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)o1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.52
MAPK8 P45983 3/20 0.51
GAA P10253 1/20 0.48
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48

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
SCHEMBL7366928 0.84 MAPK8 (0.55) KMT2AMAPK8
SCHEMBL3086802 0.81 MAPK8 (0.62) KMT2AMAPK8
SCHEMBL7365941 0.80 HPGD (0.60) KMT2AMAPK8GAA
SCHEMBL7317640 0.79 MAPK8 (0.75) KMT2AMAPK8
SCHEMBL7370389 0.78 PDE4A (0.54) KMT2AMAPK8GAAPDE4APDE4B
SCHEMBL7371215 0.78 MAPK8 (0.52) KMT2AMAPK8PDE4APDE4BPDE4C
SCHEMBL7372538 0.77 MAPK8 (0.53) KMT2AMAPK8GAAPDE4APDE4B
SCHEMBL7684087 0.77 MAPK8 (0.60) KMT2AMAPK8GAAPDE4APDE4B
SCHEMBL7375869 0.77 PDE4A (0.61) KMT2AMAPK8GAAPDE4APDE4B
SCHEMBL7371446 0.77 LMNA (0.72) KMT2AMAPK8

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