SCHEMBL5035609

SCHEMBL5035609

CC(O)COCNC(=O)c1cc(Cl)c(=O)[nH]c1Nc1ccc(I)cc1F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.41
MAP2K1 Q02750 19/20 0.41
MAP2K2 P36507 7/20 0.41
PRKCZ Q05513 1/20 0.41
IARS2 Q9NSE4 1/20 0.41
BRAF P15056 1/20 0.40
MAPK1 P28482 1/20 0.40
MAP2K5 Q13163 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
SCHEMBL5031223 0.92 MAP2K1 (0.42) KCNH2MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5028996 0.88 HSD17B10 (0.39) KCNH2MAP2K1MAP2K2
SCHEMBL5035605 0.82 MAP2K1 (0.40) KCNH2MAP2K1MAP2K2BRAFMAPK1
SCHEMBL14919911 0.79 MAP2K1 (0.38) KCNH2MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5031295 0.77 MAP2K1 (0.44) KCNH2MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5031221 0.73 MAP2K1 (0.42) KCNH2MAP2K1MAP2K2BRAFMAPK1
SCHEMBL3821432 0.73 MAP2K1 (0.48) MAP2K1MAP2K2MAP2K5
SCHEMBL5035606 0.73 MAP2K1 (0.46) MAP2K1MAP2K2MAP2K5
SCHEMBL4863539 0.71 KCNH2 (0.56) KCNH2MAP2K1MAP2K2BRAFMAPK1
SCHEMBL5028992 0.70 KCNH2 (0.37) KCNH2MAP2K1MAP2K2

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
EP-1922307-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2008-05-21 EP claimed
WO-2007044084-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-04-19 WO claimed
EP-1922307-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2008-05-21 EP disclosed
WO-2007044084-A2 HETEROCYCLIC INHIBITORS OF MEK AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-04-19 WO disclosed