SCHEMBL6005306

SCHEMBL6005306

Fc1cc2nccc(Oc3cc4cccnc4nc3-c3ccccc3)c2c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.34
NPC1 O15118 2/20 0.33
TOP1 P11387 3/20 0.32
GRM5 P41594 1/20 0.32
MET P08581 5/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
DHODH Q02127 2/20 0.31
MST1R Q04912 1/20 0.30

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
SCHEMBL6004795 0.84 FGFR2 (0.36) MAPK14NPC1TOP1METDHODH
SCHEMBL6004849 0.80 MET (0.45) METMST1R
SCHEMBL6004327 0.79 TOP1 (0.42) MAPK14NPC1TOP1PDGFRBPDGFRA
SCHEMBL6004276 0.79 LMNA (0.39) NPC1TOP1PDGFRBPDGFRADHODH
SCHEMBL6005302 0.79 DHODH (0.39) MAPK14TOP1DHODH
SCHEMBL6004171 0.78 NPC1 (0.33) NPC1METPDGFRBPDGFRADHODH
SCHEMBL6004093 0.78 MET (0.45) METPDGFRBPDGFRAMST1R
SCHEMBL6004803 0.76 FGFR2 (0.36) NPC1PDGFRBPDGFRADHODH
SCHEMBL6005342 0.76 MET (0.42) NPC1TOP1METPDGFRBPDGFRA
SCHEMBL6002787 0.76 CCNC (0.39) MAPK14NPC1DHODH

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-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed