SCHEMBL5555415

SCHEMBL5555415

Cc1[nH]c(=O)c(F)c(Nc2ccc(Br)cc2F)c1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.54
MAP2K2 P36507 2/20 0.47
KMT2A Q03164 1/20 0.43
DGAT1 O75907 1/20 0.40

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
SCHEMBL5554721 0.89 MAP2K1 (0.42) MAP2K1MAP2K2KMT2A
SCHEMBL1821414 0.83 MAP2K1 (0.46) MAP2K1MAP2K2KMT2A
SCHEMBL5554834 0.78 MAP2K1 (0.45) MAP2K1MAP2K2
SCHEMBL4228378 0.75 MAP2K1 (0.50) MAP2K1MAP2K2
SCHEMBL27883682 0.74 MAP2K1 (0.56) MAP2K1MAP2K2
SCHEMBL12540652 0.73 MAP2K1 (0.47) MAP2K1MAP2K2
SCHEMBL5559369 0.72 MAP2K1 (0.44) MAP2K1MAP2K2KMT2A
SCHEMBL30185614 0.71 MAP2K1 (0.71) MAP2K1MAP2K2DGAT1
SCHEMBL1022810 0.71 MAP2K1 (0.52) MAP2K1MAP2K2KMT2A
SCHEMBL12095333 0.70 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682138-A4 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2007-01-24 EP disclosed
EP-1682138-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2006-07-26 EP disclosed
WO-2005051301-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2005-06-09 WO disclosed