SCHEMBL20525528

SCHEMBL20525528

COc1ccc2c(Oc3ncc(NC(=O)CC(=O)Nc4ccccc4)cc3Cl)ccnc2c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.46
MERTK Q12866 2/20 0.46
PDE4D Q08499 1/20 0.45
RORC P51449 3/20 0.43
KDR P35968 3/20 0.42
PDGFRA P16234 2/20 0.42
NOTUM Q6P988 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
USP2 O75604 1/20 0.40
MET P08581 2/20 0.40
GRM4 Q14833 1/20 0.40
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
IMPDH2 P12268 1/20 0.39

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
SCHEMBL20525750 0.92 KDR (0.47) AXLMERTKKDRPDGFRAUSP2
SCHEMBL20525674 0.92 AXL (0.53) AXLMERTKPDE4DKDRPDGFRA
SCHEMBL20525766 0.90 ALDH1A1 (0.49) AXLMERTKKDRPDGFRANOTUM
SCHEMBL20525844 0.88 SMN1; SMN2 (0.49) KDRALDH1A1HPGDNPC1MEN1
SCHEMBL20525771 0.86 KDR (0.53) AXLMERTKKDRPDGFRAALDH1A1
SCHEMBL20525686 0.85 MET (0.58) AXLRORCKDRPDGFRAALDH1A1
SCHEMBL20525801 0.84 POLB (0.52) AXLMERTKPDE4DALDH1A1MET
SCHEMBL371958 0.84 PDGFRA (0.61) AXLMERTKKDRPDGFRAMET
SCHEMBL20525705 0.83 AXL (0.45) AXLMERTKKDRPDGFRAALDH1A1
SCHEMBL20525870 0.83 AXL (0.42) AXLMERTKRORCKDRPDGFRA

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