SCHEMBL28435944

SCHEMBL28435944

Cc1[nH]c2cc(Nc3ncc(Cl)c(Nc4ccccc4CS(N)(=O)=O)n3)ccc2c1C(=O)N1CC(O)C1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 18/20 0.64
▸ FLT3 P36888 3/20 0.44
▸ AXL P30530 2/20 0.43
▸ MET P08581 1/20 0.42

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
SCHEMBL28435836 0.92 ALK (0.69) ALKFLT3AXLMET
SCHEMBL28430881 0.90 ALK (0.66) ALKFLT3AXLMET
SCHEMBL28430221 0.88 ALK (0.82) ALKFLT3MET
SCHEMBL28430802 0.81 ALK (0.89) ALKFLT3MET
SCHEMBL28435838 0.79 ALK (0.88) ALKFLT3AXLMET
SCHEMBL28436291 0.79 ALK (0.86) ALKFLT3AXLMET
SCHEMBL28439025 0.78 ALK (1.00) ALKMET
SCHEMBL28435607 0.78 ALK (1.00) ALKFLT3MET
SCHEMBL28441579 0.78 ALK (0.85) ALKFLT3AXLMET
SCHEMBL30833776 0.76 ALK (0.48) ALKFLT3MET

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
CN-111484484-B 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2021-11-23 — — CN disclosed
CN-111484484-A 2, 4-diaryl aminopyrimidine derivative containing aromatic heterocycle and preparation and application thereof 沈阳药科大学 2020-08-04 — — CN disclosed
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