SCHEMBL15468554

SCHEMBL15468554

Bc1ccc(Nc2c(C(=O)NOCC3CC3)cn(CCO)c(=O)c2F)c(F)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.64
MAP2K2 P36507 2/20 0.47
RAF1 P04049 1/20 0.47
PDGFRB P09619 1/20 0.47
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47
CSNK2A3 Q8NEV1 1/20 0.47
AURKC Q9UQB9 1/20 0.47
CAMK2A Q9UQM7 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL14549255 0.92 MAP2K1 (0.65) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL391319 0.90 MAP2K1 (0.79) MAP2K1MAP2K2
SCHEMBL14549242 0.82 MAP2K1 (0.81) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL387602 0.81 MAP2K1 (0.80) MAP2K1MAP2K2
SCHEMBL14549223 0.80 MAP2K1 (0.61) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL393715 0.80 MAP2K1 (0.81) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL392922 0.79 MAP2K1 (0.83) MAP2K1MAP2K2RAF1PDGFRBCSNK2A2
SCHEMBL392824 0.79 MAP2K1 (0.72) MAP2K1MEN1KMT2ATDP1
SCHEMBL14549235 0.78 MAP2K1 (0.50) MAP2K1MAP2K2
SCHEMBL391364 0.78 MAP2K1 (0.72) MAP2K1MAP2K2

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
EP-2251327-B1 HETEROCYCLIC INHIBITORS OF MEK ARRAY BIOPHARMA INC (US) 2014-02-12 EP disclosed