SCHEMBL4546007

SCHEMBL4546007

O=C(NOCC1CC1)c1cc2c(ncn2CCCl)c(F)c1Nc1ccc(Br)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.63
MAP2K2 P36507 3/20 0.63
CSNK2A2 P19784 2/20 0.63
SMC2 O95347 1/20 0.63
EGFR P00533 1/20 0.63
SMC1A Q14683 1/20 0.63
AAK1 Q2M2I8 1/20 0.63
Q6ZSR9 Q6ZSR9 1/20 0.63
BMP2K Q9NSY1 1/20 0.63
ABCB11 O95342 1/20 0.53
NQO2 P16083 1/20 0.53
RAF1 P04049 1/20 0.51
PDGFRB P09619 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
CSNK2A3 Q8NEV1 1/20 0.51
AURKC Q9UQB9 1/20 0.51
CAMK2A Q9UQM7 1/20 0.51
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL4546027 0.96 MAP2K1 (0.62) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4545992 0.95 MAP2K1 (0.61) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4546026 0.95 MAP2K1 (0.61) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL18752862 0.94 MAP2K1 (0.68) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL18752903 0.93 MAP2K1 (0.65) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4545991 0.92 MAP2K1 (0.66) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4546020 0.92 MAP2K1 (0.66) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4546006 0.92 MAP2K1 (0.63) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL17636325 0.92 MAP2K1 (0.63) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4546000 0.92 MAP2K1 (0.65) MAP2K1MAP2K2CSNK2A2SMC2EGFR

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3000810-B1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVE AS MEK INHIBITOR ARRAY BIOPHARMA INC (US) 2017-07-19 EP disclosed
EP-1663210-B1 BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2017-04-19 EP disclosed
EP-3000810-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVE AS MEK INHIBITOR Array Biopharma, Inc. (US) 2016-03-30 EP disclosed
EP-2275102-B1 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA INC (US) 2015-07-29 EP disclosed
US-8513293-B2 Methods of treating a hyperproliferative disorder or inhibiting cell growth in a mammal ARRAY BIOPHARMA INC. (US) 2013-08-20 US disclosed
EP-2130536-B1 N3 alkylated benzimidazole derivatives as mek inhibitors ARRAY BIOPHARMA INC (US) 2013-05-08 EP disclosed
US-20120277277-A1 Methods of Treating a Hyperproliferative Disorder or Inhibiting Cell Growth in a Mammal ARRAY BIOPHARMA INC. (US) 2012-11-01 US disclosed
US-8193229-B2 Method of treatment using N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA INC. (US) 2012-06-05 US disclosed
US-8193229-B2 Method of treatment using N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA INC. (US) 2012-06-05 US disclosed
US-8193231-B2 Compositions comprising N3 alkylated benzimidazole derivatives as MEK inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-06-05 US 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
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
US-20080177082-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-07-24 US disclosed
US-20080177082-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-07-24 US disclosed
US-20080171778-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-07-17 US disclosed
US-20080171778-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-07-17 US disclosed
US-20070299063-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA, INC. (US) 2007-12-27 US disclosed
US-20070299063-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA, INC. (US) 2007-12-27 US disclosed
US-7235537-B2 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA, INC. (US) 2007-06-26 US disclosed
US-7235537-B2 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA, INC. (US) 2007-06-26 US 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 (4 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-20080171778-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS BRAF, CCNI, NRAS MAP2K1 164/4885MAP2K2 155/4885CSNK2A2 1553/4885
US-20120277277-A1 Methods of Treating a Hyperproliferative Disorder or Inhibiting Cell Growth in a Mammal PCNA, MKI67, HRAS MAP2K1 1776/4885MAP2K2 1553/4885CSNK2A2 374/4885
US-20080177082-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS BRAF, CCNI, NRAS MAP2K1 164/4885MAP2K2 155/4885CSNK2A2 1553/4885
US-20070299063-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS BRAF, CCNI, NRAS MAP2K1 170/4885MAP2K2 159/4885CSNK2A2 1229/4885

“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.