SCHEMBL20525832

SCHEMBL20525832

COc1c(OCC2CCNCC2)ccc2c(Oc3ccc(NC(=O)C(=O)NCCc4c(F)cccc4Cl)cc3F)ccnc12

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.47
P2RX4 Q99571 1/20 0.40
FLT3 P36888 2/20 0.40
KDR P35968 2/20 0.37
IGF1R P08069 1/20 0.36
AXL P30530 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36

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
SCHEMBL20525759 0.97 MET (0.48) METP2RX4FLT3KDRIGF1R
SCHEMBL20525706 0.92 MET (0.48) METFLT3KDRIGF1R
SCHEMBL20525660 0.91 MET (0.49) METFLT3KDRAXL
SCHEMBL20525672 0.90 MET (0.51) METFLT3KDRAXL
SCHEMBL20525666 0.90 MET (0.47) METFLT3KDR
SCHEMBL20525793 0.89 MET (0.50) METFLT3KDRIGF1R
SCHEMBL20525533 0.89 MET (0.48) METFLT3KDRAXL
SCHEMBL20525721 0.89 MET (0.46) METFLT3KDRAXL
SCHEMBL20525829 0.89 MET (0.47) METFLT3KDRAXL
SCHEMBL20525585 0.89 MET (0.52) METFLT3KDRIGF1RAXL

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