SCHEMBL30453971

SCHEMBL30453971

CCOc1cccc(-c2cnc(N)c(OC(C)c3c(Cl)ccc(F)c3Cl)c2)c1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.76
JAK2 O60674 2/20 0.71
ALK Q9UM73 7/20 0.66
ROS1 P08922 1/20 0.59

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
SCHEMBL488400 1.00 MET (0.76) METJAK2ALKROS1
SCHEMBL488592 0.91 MET (0.78) METJAK2ALK
SCHEMBL30454160 0.91 MET (0.78) METJAK2ALK
SCHEMBL30453067 0.89 MET (0.84) METJAK2ALK
SCHEMBL30453476 0.89 MET (0.84) METJAK2ALK
SCHEMBL488641 0.89 MET (0.84) METJAK2ALK
SCHEMBL488237 0.89 MET (0.84) METJAK2ALK
SCHEMBL30453848 0.89 MET (0.74) METJAK2ALK
SCHEMBL488151 0.89 MET (0.74) METJAK2ALK
SCHEMBL488632 0.88 MET (0.94) METJAK2ALK

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