SCHEMBL30453281

SCHEMBL30453281

CC1CN(C(=O)c2ccc(-c3cnc(N)c(OCc4cccc(F)c4C(F)(F)F)c3)cc2)CC(C)N1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MET P08581 12/20 0.56
KCNH2 Q12809 6/20 0.42
MAP4K3 Q8IVH8 1/20 0.42
MAP4K4 O95819 1/20 0.42

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
SCHEMBL10215501 1.00 MET (0.56) METKCNH2MAP4K3MAP4K4
SCHEMBL488207 1.00 MET (0.56) METKCNH2MAP4K3MAP4K4
SCHEMBL10218191 0.90 MET (0.58) METKCNH2MAP4K3MAP4K4
SCHEMBL30452782 0.88 MET (0.56) METKCNH2MAP4K3MAP4K4
SCHEMBL488693 0.88 MET (0.56) METKCNH2MAP4K3MAP4K4
SCHEMBL30453012 0.88 MET (0.61) METKCNH2MAP4K3MAP4K4
SCHEMBL488769 0.88 MET (0.61) METKCNH2MAP4K3MAP4K4
SCHEMBL5487623 0.87 MET (0.45) METKCNH2
SCHEMBL10218163 0.87 MET (0.56) METKCNH2MAP4K3MAP4K4
SCHEMBL10218167 0.86 MET (0.56) METKCNH2MAP4K3MAP4K4

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
CN-113181362-B Medicament for preventing and/or treating amyotrophic lateral sclerosis 国立大学法人京都大学 2023-06-13 CN disclosed