SCHEMBL13063861

SCHEMBL13063861

COc1cc(=O)n(C)c(Nc2ccc(I)cc2Cl)c1NS(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.48
BRD1 O95696 7/20 0.45
BRPF1 P55201 7/20 0.45
BRPF3 Q9ULD4 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TRIM24 O15164 6/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MCOLN2 Q8IZK6 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
MCOLN1 Q9GZU1 1/20 0.37
HTR6 P50406 1/20 0.37
CRHBP P24387 1/20 0.36

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
SCHEMBL3804582 0.90 MAP2K1 (0.42) MAP2K1MEN1KMT2AKDM4EPOLB
SCHEMBL3804902 0.88 MAP2K1 (0.62) MAP2K1BRD1BRPF1BRPF3MEN1
SCHEMBL13063853 0.88 SRC (0.38) MAP2K1MEN1KMT2AKDM4EHSD17B10
SCHEMBL3803390 0.87 MAP2K1 (0.35) MAP2K1BRD1BRPF1BRPF3MEN1
SCHEMBL13063827 0.86 LMNA (0.39) MAP2K1BRPF1HSD17B10ALDH1A1HPGD
SCHEMBL13063540 0.85 SRC (0.37) MAP2K1KMT2AHSD17B10MAPTHPGD
SCHEMBL3801437 0.85 ALDH1A1 (0.44) MEN1KMT2APOLBMAPTALDH1A1
SCHEMBL3804823 0.84 ADRA2A (0.36) MAP2K1BRPF1TRIM24
SCHEMBL3809160 0.83 LRRK2 (0.35) MAP2K1HSD17B10HPGD
SCHEMBL13063539 0.82 SRC (0.35) MAPTALDH1A1

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
WO-2010145197-A1 NOVEL 6-ARYLAMINO PYRIDONE SULFONAMIDES AND 6-ARYLAMINO PYRAZINONE SULFONAMDIES AS MEK INHIBITORS CHEMIZON (BEIJING), LTD. (CN) 2010-12-23 WO disclosed