SCHEMBL6948484

SCHEMBL6948484

C#Cc1ccc(Nc2cc(F)ccc2C(=O)NOCC2CC2)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.64
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAP2K2 P36507 2/20 0.43
RAF1 P04049 1/20 0.43
PDGFRB P09619 1/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
CSNK2A3 Q8NEV1 1/20 0.43
AURKC Q9UQB9 1/20 0.43
CAMK2A Q9UQM7 1/20 0.43

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
SCHEMBL6941113 0.89 MAP2K1 (0.56) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL5991985 0.86 MAP2K1 (0.62) MAP2K1MAP2K2
SCHEMBL6943863 0.85 MAP2K1 (0.60) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL5398773 0.85 MAP2K1 (0.75) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL6945033 0.85 MAP2K1 (0.61) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL6943933 0.83 MAP2K1 (0.57) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL6947497 0.83 MEN1 (0.75) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL6943682 0.82 MAP2K1 (0.55) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL6946598 0.81 MEN1 (0.62) MAP2K1MEN1KMT2ATDP1MAP2K2
SCHEMBL24196047 0.79 MAP2K1 (0.82) MAP2K1MEN1KMT2ATDP1MAP2K2

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 6 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