SCHEMBL20525591

SCHEMBL20525591

COc1c(OCC2CCNCC2)ccc2c(Oc3ccc(NC(=O)C(=O)NCCc4ccc(Oc5ccccc5)cc4)cc3F)ccnc12

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.51
POLB P06746 1/20 0.41
KDR P35968 8/20 0.41
IGF1R P08069 7/20 0.41
TDP1 Q9NUW8 1/20 0.41
FLT3 P36888 2/20 0.40

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
SCHEMBL20525585 0.95 MET (0.52) METPOLBKDRIGF1RFLT3
SCHEMBL20525737 0.95 MET (0.48) METPOLBKDRIGF1RTDP1
SCHEMBL20525630 0.93 MET (0.47) METPOLBKDRIGF1RTDP1
SCHEMBL20525684 0.93 MET (0.47) METKDRTDP1FLT3
SCHEMBL20525574 0.92 MET (0.47) METPOLBKDRFLT3
SCHEMBL20525837 0.92 MET (0.47) METPOLBKDRTDP1FLT3
SCHEMBL20525690 0.92 MET (0.48) METPOLBKDRIGF1RTDP1
SCHEMBL20525829 0.91 MET (0.47) METPOLBKDRFLT3
SCHEMBL20525651 0.91 MET (0.48) METPOLBKDRTDP1FLT3
SCHEMBL20525522 0.91 MET (0.51) METPOLBKDRFLT3

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