SCHEMBL12836734

SCHEMBL12836734

Bc1ccc(Nc2c(NS(=O)(=O)C3CC3)cn(C)c(=O)c2Cl)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.48
MAP2K1 Q02750 11/20 0.43
BRD4 O60885 2/20 0.34
KIT P10721 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TLR4 O00206 1/20 0.33

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
SCHEMBL1516487 0.88 MAP2K1 (0.55) BRAFMAP2K1TSHR
SCHEMBL1516512 0.88 BRAF (0.48) BRAFMAP2K1
SCHEMBL18086455 0.78 BRAF (0.48) BRAFMAP2K1BRD4TSHRHSD17B10
SCHEMBL9284438 0.78 BRAF (0.48) BRAFMAP2K1BRD4
SCHEMBL1516484 0.78 MAP2K1 (0.58) BRAFMAP2K1TSHR
SCHEMBL1516527 0.78 MAP2K1 (0.45) BRAFMAP2K1
SCHEMBL720442 0.77 MAP2K1 (0.51) BRAFMAP2K1
SCHEMBL13113284 0.75 BRAF (0.34) BRAFMAP2K1BRD4
SCHEMBL14549221 0.75 MAP2K1 (0.59) MAP2K1
SCHEMBL14549220 0.74 MAP2K1 (0.60) MAP2K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7897624-B2 Pyridone sulfonamides and pyridone sulfamides as MEK inhibitors ARDEA BIOSCIENCES (US) 2011-03-01 US disclosed
WO-2009018238-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. (US) 2009-02-05 WO disclosed