SCHEMBL30452558

SCHEMBL30452558

Nc1ncc(-c2cccc(F)c2)cc1OCc1c(Cl)cccc1Cl

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.71
FYN P06241 2/20 0.50
JAK2 O60674 4/20 0.47
MPO P05164 3/20 0.46
CYP3A4 P08684 1/20 0.46
MAP4K3 Q8IVH8 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CHEK2 O96017 1/20 0.43
MAP4K4 O95819 2/20 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
SCHEMBL487619 1.00 MET (0.71) METFYNJAK2MPOCYP3A4
SCHEMBL488042 0.90 MET (0.79) METFYNJAK2MPOMAP4K3
SCHEMBL487572 0.88 MET (0.73) METFYNJAK2MPOMAP4K3
SCHEMBL487907 0.88 MET (0.81) METFYNJAK2MPOMAP4K3
SCHEMBL487624 0.88 MET (0.72) METFYNJAK2MPOMAP4K3
SCHEMBL30453540 0.88 MET (0.72) METFYNJAK2MPOMAP4K3
SCHEMBL487730 0.87 MET (0.79) METFYNJAK2MPOMAP4K3
SCHEMBL30454723 0.87 MET (0.79) METFYNJAK2MPOMAP4K3
Water SCHEMBL28121971 0.87 MET (0.79) METFYNJAK2MPOMAP4K3
SCHEMBL488145 0.85 MET (0.68) METJAK2MAP4K3MEN1KMT2A

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