SCHEMBL7809609

SCHEMBL7809609

Cc1cc(-c2cnsn2)ccc1Nc1c(F)c(F)c(F)c(OCC2CC2)c1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.36
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CNR2 P34972 1/20 0.32
BTK Q06187 1/20 0.31
MAP2K1 Q02750 5/20 0.31
RPS6KB1 P23443 1/20 0.31
AKT1 P31749 1/20 0.31
CYP2C9 P11712 1/20 0.30
RAF1 P04049 1/20 0.30
PDGFRB P09619 1/20 0.30
CSNK2A2 P19784 1/20 0.30
MAP2K2 P36507 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CSNK2A3 Q8NEV1 1/20 0.30
AURKC Q9UQB9 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
SCHEMBL6944622 0.79 MEN1 (0.67) MEN1KMT2ATDP1MAP2K1RAF1
SCHEMBL7122095 0.78 MEN1 (0.44) MEN1KMT2ATDP1MAPK1GFER
SCHEMBL7808212 0.78 MEN1 (0.35) MEN1KMT2ATDP1CNR2BTK
SCHEMBL7120487 0.78 MEN1 (0.43) MEN1KMT2ATDP1MAPK1GFER
SCHEMBL6945160 0.70 MEN1 (0.41) MEN1KMT2ATDP1MAPK1GFER
SCHEMBL6947401 0.69 MAP2K1 (0.56) MEN1KMT2ATDP1CNR2MAP2K1
SCHEMBL6948332 0.69 MEN1 (0.42) MEN1KMT2ATDP1MAPK1GFER
SCHEMBL7463511 0.68 MEN1 (0.46) MEN1KMT2ATDP1MAP2K1RAF1
SCHEMBL7784132 0.68 KMT2A (0.46) MEN1KMT2ATDP1SMN1; SMN2MAP2K1
SCHEMBL7123642 0.67 MEN1 (0.47) MEN1KMT2ATDP1MAP2K1RAF1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1150950-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2001-11-07 EP claimed
WO-2000041505-A2 ANTHRANILIC ACID DERIVATIVES WARNER-LAMBERT COMPANY (US) 2000-07-20 WO claimed