SCHEMBL20525664

SCHEMBL20525664

COc1cccc(CNC(=O)C(=O)Nc2ccc(Oc3ccnc4c(OC)c(OCC5CCNCC5)ccc34)c(F)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 14/20 0.49
FLT3 P36888 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDR P35968 6/20 0.39
IGF1R P08069 5/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 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
SCHEMBL20525681 0.94 MET (0.47) METFLT3KDRIGF1R
SCHEMBL20525690 0.94 MET (0.48) METFLT3KDRIGF1RALDH1A1
SCHEMBL20525701 0.94 MET (0.49) METFLT3KDRIGF1R
SCHEMBL20525683 0.93 MET (0.48) METFLT3KDR
SCHEMBL20525667 0.93 MET (0.53) METFLT3KDRIGF1R
SCHEMBL20525691 0.93 MET (0.47) METFLT3KDR
SCHEMBL20525650 0.93 MET (0.49) METFLT3SMN1; SMN2KDRIGF1R
SCHEMBL20525802 0.92 MET (0.46) METFLT3LMNASMN1; SMN2KDR
SCHEMBL20525751 0.91 MET (0.47) METFLT3KDR
SCHEMBL20525653 0.90 MET (0.48) METFLT3KDR

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