SCHEMBL6946757

SCHEMBL6946757

Cc1cc(-c2nsnc2OCCN2CCOCC2)ccc1Nc1c(C(=O)NO)cc(F)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK14 Q16539 2/20 0.37
EGFR P00533 1/20 0.37
KDR P35968 3/20 0.37
FLT3 P36888 2/20 0.37
AURKA O14965 1/20 0.37
TNIK Q9UKE5 1/20 0.36
KDM1A O60341 1/20 0.36
HDAC1 Q13547 1/20 0.36
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
MET P08581 1/20 0.36
KIT P10721 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
HIF1A Q16665 1/20 0.35
RET P07949 1/20 0.35
GRM4 Q14833 1/20 0.35

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
SCHEMBL6943774 0.82 MEN1 (0.56) MEN1KMT2ATDP1KDRKCNH2
SCHEMBL6946730 0.79 MEN1 (0.36) MEN1KMT2ATDP1
SCHEMBL6945840 0.78 MEN1 (0.42) MEN1KMT2ATDP1TNIKHDAC1
SCHEMBL6947376 0.76 MEN1 (0.38) MEN1KMT2ATDP1TNIKPIK3R1
SCHEMBL6943566 0.74 MAP2K1 (0.47) MEN1KMT2ATDP1EGFR
SCHEMBL7808212 0.71 MEN1 (0.35) MEN1KMT2ATDP1
SCHEMBL6948332 0.71 MEN1 (0.42) MEN1KMT2ATDP1TNIKHDAC1
SCHEMBL6944936 0.69 MEN1 (0.67) MEN1KMT2ATDP1EGFRKDR
SCHEMBL6941232 0.69 MEN1 (0.41) MEN1KMT2ATDP1
SCHEMBL5940451 0.68 MEN1 (0.56) MEN1KMT2ATDP1HDAC1PIK3R1

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