SCHEMBL7368665

SCHEMBL7368665

O=C(NCc1ccccc1F)c1cccnc1Oc1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.67
MAPK8 P45983 5/20 0.63
ALDH1A1 P00352 1/20 0.52
NPC1 O15118 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL7363107 0.87 MAPK8 (0.83) MAPK8ALDH1A1
SCHEMBL7370313 0.83 MAPK8 (0.67) MAPK8
SCHEMBL7369449 0.83 MAPK8 (0.63) LMNAMAPK8ALDH1A1HPGD
SCHEMBL7366565 0.83 MAPK8 (0.73) LMNAMAPK8ALDH1A1HPGD
SCHEMBL30989915 0.82 LMNA (0.80) LMNAMAPK8ALDH1A1GAAHPGD
SCHEMBL7363366 0.81 MAPK8 (0.55) LMNAMAPK8ALDH1A1
SCHEMBL7450186 0.81 MAPK8 (0.55) LMNAMAPK8ALDH1A1
SCHEMBL7369138 0.80 MAPK8 (0.69) LMNAMAPK8ALDH1A1HPGD
SCHEMBL7364353 0.79 HPGD (0.68) LMNAMAPK8GAAHPGD
SCHEMBL7366862 0.78 MAPK8 (0.56) MAPK8ALDH1A1GAA

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