SCHEMBL3860786

SCHEMBL3860786

C#Cc1ccc(Nc2c(C(=O)OCC3CC3)cc3[nH]c(C(N)=O)nc3c2F)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAP2K1 Q02750 11/20 0.36
PARP1 P09874 5/20 0.33
MAP2K2 P36507 2/20 0.32
RAF1 P04049 1/20 0.32
PDGFRB P09619 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
AURKC Q9UQB9 1/20 0.32
CAMK2A Q9UQM7 1/20 0.32
DHODH Q02127 1/20 0.32
PTGES O14684 1/20 0.31
PARP2 Q9UGN5 2/20 0.31
CD38 P28907 1/20 0.31
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL2885084 0.93 MAP2K1 (0.44) MEN1KMT2ATDP1MAP2K1PARP1
SCHEMBL3864888 0.90 MEN1 (0.40) MEN1KMT2ATDP1MAP2K1PARP1
SCHEMBL3862127 0.88 MEN1 (0.55) MEN1KMT2ATDP1MAP2K1PARP1
SCHEMBL1040177 0.88 MEN1 (0.43) MEN1KMT2ATDP1MAP2K1PARP1
SCHEMBL1042057 0.80 MAP2K1 (0.41) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL5988795 0.76 MEN1 (0.55) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL3860779 0.75 MEN1 (0.54) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL6947497 0.73 MEN1 (0.75) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL2877124 0.72 HPGD (0.41) MEN1KMT2ATDP1MAP2K1PARP1
SCHEMBL19141022 0.71 MAP2K1 (0.40) MEN1KMT2AMAP2K1PARP1MAP2K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663210-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2009-04-22 EP disclosed
US-7425637-B2 mitogen-activated protein/extracellular signal-regulated (MAP/ERK)Kinase pathways; 6-(4-bromo-2-fluorophenylamino)-7-fluoro-3-methyl-3H-benzoimidazole-5-carboxylic acid (2-hydroxyethoxy)-amide; hyperproliferative diseases; anticarcinogenic and antiinflammatory agent ARRAY BIOPHARMA INC. (US) 2008-09-16 US disclosed
EP-1663210-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS Array Biopharma, Inc. (US) 2006-06-07 EP disclosed
EP-1482932-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2006-04-05 EP disclosed
US-20050143438-A1 N3 alkylated benzimidazole derivatives as MEk inhibitors ALEXION PHARMA INTERNATIONAL OPERATIONS LIMITED (IE) 2005-06-30 US disclosed
WO-2005023251-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2005-03-17 WO disclosed
EP-1482932-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS Array Biopharma, Inc. (US) 2004-12-08 EP disclosed
WO-2003077914-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA, INC (US) 2003-09-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050143438-A1 N3 alkylated benzimidazole derivatives as MEk inhibitors BRAF, CCNI, NRAS MEN1 1151/4885KMT2A 1415/4885TDP1 1269/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.