SCHEMBL30453554

SCHEMBL30453554

CCN(CC)CCS(=O)(=O)Nc1ccc(-c2cnc(N)c(OC(C)c3c(F)ccc(F)c3Cl)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.44
MAP4K3 Q8IVH8 1/20 0.42
ALK Q9UM73 3/20 0.37
CHEK2 O96017 1/20 0.36
SGK1 O00141 6/20 0.36
ROS1 P08922 1/20 0.36
CYP3A4 P08684 1/20 0.34
SGK3 Q96BR1 1/20 0.34
SGK2 Q9HBY8 1/20 0.34

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
SCHEMBL488469 1.00 MET (0.44) METMAP4K3ALKCHEK2SGK1
SCHEMBL30453563 0.95 MET (0.49) METMAP4K3ALKROS1
SCHEMBL488429 0.95 MET (0.49) METMAP4K3ALKROS1
SCHEMBL30453613 0.92 MET (0.45) METMAP4K3ALKCHEK2SGK1
SCHEMBL488524 0.92 MET (0.45) METMAP4K3ALKCHEK2SGK1
SCHEMBL30453170 0.87 MET (0.51) METMAP4K3ALKROS1
SCHEMBL488256 0.87 MET (0.51) METMAP4K3ALKROS1
SCHEMBL30453267 0.85 MET (0.53) METALKROS1
SCHEMBL487871 0.85 MET (0.53) METALKROS1
SCHEMBL487801 0.85 MET (0.51) METMAP4K3ALKCHEK2SGK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4599890-A2 SUNITINIB FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS Kyoto University (JP) 2025-08-13 EP disclosed
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