SCHEMBL30453935

SCHEMBL30453935

CC(Oc1nc(-c2ccncc2)cnc1N)c1c(Cl)ccc(F)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP4K3 Q8IVH8 1/20 0.61
MET P08581 14/20 0.58
JAK2 O60674 1/20 0.55
INPPL1 O15357 4/20 0.51

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
SCHEMBL488414 1.00 MAP4K3 (0.61) MAP4K3METJAK2INPPL1
SCHEMBL5486840 0.90 MAP4K3 (0.62) MAP4K3METJAK2INPPL1
SCHEMBL27630152 0.88 MAP4K3 (0.60) MAP4K3METJAK2INPPL1
SCHEMBL1581781 0.85 MET (0.70) MAP4K3METJAK2INPPL1
SCHEMBL12004304 0.85 MET (0.58) MAP4K3METJAK2INPPL1
SCHEMBL30453250 0.85 MET (0.58) MAP4K3METJAK2
SCHEMBL1900159 0.85 MET (0.58) MAP4K3METJAK2
SCHEMBL488464 0.85 MET (0.58) MAP4K3METJAK2
SCHEMBL5486835 0.85 MET (0.58) MAP4K3METJAK2
SCHEMBL488495 0.85 MET (0.58) MAP4K3METJAK2

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