SCHEMBL20525630

SCHEMBL20525630

CCOc1ccc(CCNC(=O)C(=O)Nc2ccc(Oc3ccnc4c(OC)c(OCC5CCNCC5)ccc34)c(F)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 14/20 0.47
FLT3 P36888 2/20 0.40
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.38
IGF1R P08069 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL20525737 0.95 MET (0.48) METFLT3MAPTTDP1POLB
SCHEMBL20525837 0.94 MET (0.47) METFLT3TDP1POLBKDR
SCHEMBL20525684 0.93 MET (0.47) METFLT3TDP1KDR
SCHEMBL20525586 0.93 MET (0.47) METFLT3TDP1POLBIGF1R
SCHEMBL20525591 0.93 MET (0.51) METFLT3TDP1POLBIGF1R
SCHEMBL20525627 0.93 MET (0.48) METFLT3POLBKDR
SCHEMBL20525813 0.93 MET (0.48) METFLT3POLBKDR
SCHEMBL20525574 0.93 MET (0.47) METFLT3POLBKDR
SCHEMBL20525756 0.92 MET (0.47) METFLT3TDP1POLBKDR
SCHEMBL20525651 0.92 MET (0.48) METFLT3TDP1POLBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2101759-B1 METHODS OF USING MEK INHIBITORS EXELIXIS INC (US) 2018-10-10 EP claimed