SCHEMBL30453603

SCHEMBL30453603

CC(Oc1nc(-c2ccc(NS(=O)(=O)CCN3CC[C@@H](O)C3)cc2)cnc1N)c1c(F)ccc(F)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.47
MAP4K3 Q8IVH8 1/20 0.45
CHEK2 O96017 1/20 0.40
S1PR1 P21453 4/20 0.35
PDCD1 Q15116 2/20 0.34
CD274 Q9NZQ7 2/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 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
SCHEMBL488174 1.00 MET (0.47) METMAP4K3CHEK2S1PR1PDCD1
SCHEMBL488533 0.96 MET (0.53) METMAP4K3CHEK2
SCHEMBL30452957 0.96 MET (0.53) METMAP4K3CHEK2
SCHEMBL30453377 0.96 MET (0.50) METMAP4K3CHEK2JAK2JAK3
SCHEMBL487733 0.96 MET (0.50) METMAP4K3CHEK2JAK2JAK3
SCHEMBL30453407 0.92 MET (0.56) METMAP4K3CHEK2
SCHEMBL488484 0.92 MET (0.56) METMAP4K3CHEK2
SCHEMBL30453827 0.89 MET (0.51) METMAP4K3CHEK2
SCHEMBL488603 0.89 MET (0.51) METMAP4K3CHEK2
SCHEMBL488234 0.89 MET (0.51) METMAP4K3CHEK2

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