SCHEMBL6950416

SCHEMBL6950416

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

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAP2K1 Q02750 14/20 0.45
MAPK1 P28482 1/20 0.40
MAP2K2 P36507 1/20 0.38
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
GFER P55789 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6946674 0.90 MAP2K1 (0.42) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6946266 0.88 MAP2K1 (0.42) MAP2K1MAP2K2HDAC1HDAC6
SCHEMBL6944532 0.88 MEN1 (0.47) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6945177 0.86 MAP2K1 (0.45) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL5403672 0.82 MEN1 (0.66) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6947497 0.81 MEN1 (0.75) MEN1KMT2ATDP1MAP2K1MAP2K2
SCHEMBL6943879 0.80 KMT2A (0.48) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6949203 0.79 MEN1 (0.47) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6948269 0.79 MEN1 (0.45) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6946588 0.79 MAP2K1 (0.55) MEN1KMT2AMAP2K1MAPK1MAP2K2

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