SCHEMBL6946643

SCHEMBL6946643

C#Cc1ccc(Nc2c(C(=O)NO)cc(Br)c(F)c2F)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 14/20 0.42
MAP2K2 P36507 4/20 0.39
CSNK2A2 P19784 2/20 0.35
SMC2 O95347 1/20 0.35
EGFR P00533 1/20 0.35
SMC1A Q14683 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
Q6ZSR9 Q6ZSR9 1/20 0.35
BMP2K Q9NSY1 1/20 0.35
RAF1 P04049 1/20 0.34
PDGFRB P09619 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CSNK2A3 Q8NEV1 1/20 0.34
AURKC Q9UQB9 1/20 0.34
CAMK2A Q9UQM7 1/20 0.34
CSF1R P07333 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL6945177 0.90 MAP2K1 (0.45) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL6944105 0.90 MAP2K1 (0.47) MAP2K1MAP2K2CSF1RMEN1KMT2A
SCHEMBL6946674 0.86 MAP2K1 (0.42) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL6946169 0.85 MAP2K1 (0.53) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL6944419 0.83 MAP2K1 (0.57) MAP2K1MAP2K2CSNK2A2SMC2EGFR
SCHEMBL5388056 0.82 MAP2K1 (0.58) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL6941241 0.78 MAP2K1 (0.52) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB
SCHEMBL6950416 0.76 MEN1 (0.47) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL6948269 0.76 MEN1 (0.45) MAP2K1MAP2K2MEN1KMT2ATDP1
SCHEMBL6948257 0.75 MAP2K1 (0.68) MAP2K1MAP2K2CSNK2A2RAF1PDGFRB

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
EP-1202724-B1 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER LAMBERT CO (US) 2003-10-01 EP claimed
JP-2003504401-A 2003-02-04 JP claimed
EP-1202724-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-05-08 EP claimed
EP-1150950-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2001-11-07 EP claimed
WO-2001005393-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO claimed
WO-2000041505-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2000-07-20 WO claimed
EP-1202724-B1 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER LAMBERT CO (US) 2003-10-01 EP disclosed
EP-1202724-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2002-05-08 EP disclosed
EP-1150950-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2001-11-07 EP disclosed
WO-2001005393-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO disclosed
WO-2000041505-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2000-07-20 WO disclosed