SCHEMBL2277841

SCHEMBL2277841

Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(C=O)cc21

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 9/20 0.60
EGFR P00533 3/20 0.60
MAP2K2 P36507 2/20 0.60
SMC2 O95347 1/20 0.60
CSNK2A2 P19784 1/20 0.60
SMC1A Q14683 1/20 0.60
AAK1 Q2M2I8 1/20 0.60
Q6ZSR9 Q6ZSR9 1/20 0.60
BMP2K Q9NSY1 1/20 0.60
ABCB11 O95342 1/20 0.48
NQO2 P16083 1/20 0.48
SRC P12931 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
BRAF P15056 1/20 0.32

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
SCHEMBL22567666 0.89 MAP2K1 (0.58) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL22354901 0.86 MAP2K1 (0.63) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL19014958 0.85 MAP2K1 (0.61) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL2021981 0.84 MAP2K1 (0.47) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL18752668 0.83 MAP2K1 (0.50) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL3859993 0.83 MAP2K1 (0.58) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL18752853 0.83 MAP2K1 (0.47) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL1488195 0.82 MAP2K1 (0.71) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL30733259 0.82 MAP2K1 (0.71) MAP2K1EGFRMAP2K2SMC2CSNK2A2
SCHEMBL30746854 0.82 MAP2K1 (0.71) MAP2K1EGFRMAP2K2SMC2CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023238000-A1 PROCESS FOR PREPARATION OF SELUMETINIB AND SALTS THEREOF GLENMARK LIFE SCIENCES LIMITED (IN) 2023-12-14 WO disclosed
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
US-8003805-B2 N3 alkylated benzimidazole derivatives as MEK inhibitors ARRAY BIOPHARMA INC. (US) 2011-08-23 US disclosed
US-20100261717-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-10-14 US disclosed
EP-1663210-A4 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS ARRAY BIOPHARMA INC (US) 2009-04-22 EP 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
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-20100261717-A1 N3 ALKYLATED BENZIMIDAZOLE DERIVATIVES AS MEK INHIBITORS BRAF, CCNI, NRAS MAP2K1 164/4885EGFR 206/4885MAP2K2 155/4885

“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.