SCHEMBL27659366

SCHEMBL27659366

CCOC(=O)c1cn(C)c(=O)c(F)c1Nc1ccc(C)cc1F

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.61
MAP2K2 P36507 3/20 0.57
BAZ2B Q9UIF8 1/20 0.43
BAZ2A Q9UIF9 1/20 0.43
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 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
SCHEMBL392127 0.86 MAP2K1 (0.81) MAP2K1MAP2K2
SCHEMBL27679442 0.85 MAP2K1 (0.78) MAP2K1MAP2K2
SCHEMBL27659369 0.84 MAP2K1 (0.63) MAP2K1MAP2K2
SCHEMBL14549012 0.82 MAP2K1 (0.80) MAP2K1MAP2K2
SCHEMBL5622965 0.82 MAP2K1 (0.82) MAP2K1MAP2K2BAZ2BBAZ2A
SCHEMBL27883692 0.80 MAP2K1 (0.59) MAP2K1MAP2K2
SCHEMBL27867329 0.80 MAP2K1 (0.76) MAP2K1MAP2K2
SCHEMBL6526634 0.78 MAP2K1 (0.76) MAP2K1MAP2K2BAZ2BBAZ2A
SCHEMBL392922 0.78 MAP2K1 (0.83) MAP2K1MAP2K2
SCHEMBL393588 0.77 MAP2K1 (0.49) MAP2K1MAP2K2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1905873-A Heterocyclic inhibitors of MEK and methods of use thereof ARRAY BIOPHARMA INC (US) 2007-01-31 CN disclosed