SCHEMBL6944105

SCHEMBL6944105

C#Cc1ccc(Nc2c(C(=O)O)cc(Br)c(F)c2F)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 12/20 0.47
MAP2K2 P36507 3/20 0.37
CLCN2 P51788 1/20 0.35
FABP3 P05413 1/20 0.34
FABP4 P15090 1/20 0.34
FTO Q9C0B1 2/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
CSF1R P07333 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 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
SCHEMBL6946643 0.90 MAP2K1 (0.42) MAP2K1MAP2K2CSF1RCA1CA2
SCHEMBL6941241 0.88 MAP2K1 (0.52) MAP2K1MAP2K2CLCN2FABP3FABP4
SCHEMBL6948269 0.86 MEN1 (0.45) MAP2K1MAP2K2CLCN2ADRA2BADRA2C
SCHEMBL6948257 0.83 MAP2K1 (0.68) MAP2K1MAP2K2CLCN2ADRA2BADRA2C
SCHEMBL3429050 0.83 MAP2K1 (0.47) MAP2K1CLCN2FABP3FABP4FTO
SCHEMBL4856761 0.82 MAP2K1 (0.70) MAP2K1MAP2K2
SCHEMBL6944419 0.80 MAP2K1 (0.57) MAP2K1MAP2K2MEN1KMT2A
SCHEMBL6945177 0.79 MAP2K1 (0.45) MAP2K1MAP2K2MEN1KMT2A
SCHEMBL6950981 0.79 MAP2K1 (0.47) MAP2K1MAP2K2CLCN2FTOMEN1
SCHEMBL6951081 0.78 LMNA (0.48) MAP2K1CA1CA2

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