SCHEMBL13601915

SCHEMBL13601915

COCCn1cnc2c(F)c(Nc3ccc(C)cc3Cl)c(C(=O)NOCC3CC3)cc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.56
MAP2K2 P36507 3/20 0.56
CSNK2A2 P19784 2/20 0.56
SMC2 O95347 1/20 0.56
EGFR P00533 1/20 0.56
SMC1A Q14683 1/20 0.56
AAK1 Q2M2I8 1/20 0.56
Q6ZSR9 Q6ZSR9 1/20 0.56
BMP2K Q9NSY1 1/20 0.56
RAF1 P04049 1/20 0.50
PDGFRB P09619 1/20 0.50
CSNK2B P67870 1/20 0.50
CSNK2A1 P68400 1/20 0.50
CSNK2A3 Q8NEV1 1/20 0.50
AURKC Q9UQB9 1/20 0.50
CAMK2A Q9UQM7 1/20 0.50
ABCB11 O95342 1/20 0.48
NQO2 P16083 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL19141247 0.93 MAP2K1 (0.54) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL4546020 0.93 MAP2K1 (0.66) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL5742991 0.92 MAP2K1 (0.62) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL12957413 0.92 MAP2K1 (0.54) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL19141294 0.92 MAP2K1 (0.54) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL18752869 0.90 MAP2K1 (0.52) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL13599301 0.90 MAP2K1 (0.54) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL12957095 0.89 MAP2K1 (0.51) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL13636511 0.89 MAP2K1 (0.51) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL18752870 0.88 MAP2K1 (0.63) 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 2 patents. 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-2130536-A1 N3 alkylated benzimidazole derivatives as mek inhibitors Array Biopharma, Inc. (US) 2009-12-09 EP disclosed