SCHEMBL30452968

SCHEMBL30452968

Nc1ncc(-c2ccc(C(=O)O)cc2)cc1OCc1ccc(F)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 12/20 0.64
MET P08581 5/20 0.51
NR4A2 P43354 1/20 0.46
JAK2 O60674 1/20 0.44
FEN1 P39748 1/20 0.44

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
SCHEMBL487734 1.00 MAP4K4 (0.64) MAP4K4METNR4A2JAK2FEN1
SCHEMBL30454350 0.90 MAP4K4 (0.65) MAP4K4METNR4A2
SCHEMBL487663 0.90 MAP4K4 (0.65) MAP4K4METNR4A2
SCHEMBL30453255 0.88 MET (0.65) MAP4K4METJAK2
SCHEMBL487782 0.88 MET (0.65) MAP4K4METJAK2
SCHEMBL30454971 0.87 MAP4K4 (0.73) MAP4K4METNR4A2
SCHEMBL487832 0.87 MAP4K4 (0.73) MAP4K4METNR4A2
SCHEMBL487833 0.86 JAK2 (0.58) MAP4K4METJAK2
SCHEMBL30453620 0.83 MET (0.55) MAP4K4MET
SCHEMBL30452936 0.83 MET (0.55) MET

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