SCHEMBL7369712

SCHEMBL7369712

O=C(NCc1c(F)cc(F)cc1F)c1cccnc1Oc1ccc(F)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.59
KMT2A Q03164 1/20 0.57
GAA P10253 1/20 0.53

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
SCHEMBL7365751 0.87 MAPK8 (0.67) MAPK8KMT2A
SCHEMBL7317640 0.86 MAPK8 (0.75) MAPK8KMT2A
SCHEMBL7368492 0.85 MAPK8 (0.62) MAPK8KMT2A
SCHEMBL5366397 0.83 PDE4A (0.56) MAPK8KMT2A
SCHEMBL7364112 0.82 MAPK8 (0.61) MAPK8KMT2AGAA
SCHEMBL7168843 0.82 MAPK8 (0.72) MAPK8KMT2AGAA
SCHEMBL7371983 0.82 MAPK8 (0.69) MAPK8KMT2A
SCHEMBL7371446 0.81 LMNA (0.72) MAPK8KMT2A
SCHEMBL7375869 0.81 PDE4A (0.61) MAPK8KMT2AGAA
SCHEMBL7363675 0.81 MAPK8 (0.67) 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 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