SCHEMBL6945840

SCHEMBL6945840

Cc1cc(-c2nsnc2Cl)ccc1Nc1c(C(=O)NO)cc(F)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAP2K1 Q02750 4/20 0.37
MAPK1 P28482 1/20 0.35
FTO Q9C0B1 4/20 0.35
DHODH Q02127 2/20 0.33
THRB P10828 1/20 0.32
TNIK Q9UKE5 1/20 0.31
POLB P06746 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MAPT P10636 1/20 0.31
GFER P55789 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6941232 0.90 MEN1 (0.41) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6946730 0.84 MEN1 (0.36) MEN1KMT2ATDP1MAPK1FTO
SCHEMBL6944936 0.83 MEN1 (0.67) MEN1KMT2ATDP1MAP2K1
SCHEMBL6948332 0.82 MEN1 (0.42) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6946757 0.78 MEN1 (0.39) MEN1KMT2ATDP1TNIKHDAC1
SCHEMBL5403672 0.76 MEN1 (0.66) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6943879 0.74 KMT2A (0.48) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6944483 0.74 MAP2K1 (0.57) MEN1KMT2ATDP1MAP2K1
SCHEMBL6949203 0.73 MEN1 (0.47) MEN1KMT2ATDP1MAP2K1MAPK1
SCHEMBL6950416 0.73 MEN1 (0.47) MEN1KMT2ATDP1MAP2K1MAPK1

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 4 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
WO-2001005393-A2 METHOD FOR TREATING CHRONIC PAIN USING MEK INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-01-25 WO claimed