SCHEMBL28430786

SCHEMBL28430786

CCOC(=O)c1c(C)[nH]c2cc(Nc3ncc(Cl)c(Nc4ccccc4NS(C)(=O)=O)n3)ccc12

nearest known ligand 0.87

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 13/20 0.87
▸ MET P08581 2/20 0.57
▸ FLT3 P36888 2/20 0.55
▸ PTK2 Q05397 1/20 0.50
▸ EGFR P00533 3/20 0.48
▸ GLO1 Q04760 2/20 0.48
▸ MAPK3 P27361 1/20 0.48

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
SCHEMBL28436289 0.93 ALK (1.00) ALKMETFLT3PTK2EGFR
SCHEMBL28430835 0.90 ALK (0.85) ALKMETFLT3PTK2EGFR
SCHEMBL28438028 0.87 ALK (0.78) ALKMETFLT3PTK2EGFR
SCHEMBL28435838 0.85 ALK (0.88) ALKMETFLT3EGFR
SCHEMBL28432985 0.85 ALK (0.82) ALKMETFLT3EGFR
SCHEMBL28436291 0.84 ALK (0.86) ALKMETFLT3EGFR
SCHEMBL28441579 0.83 ALK (0.85) ALKMETFLT3EGFR
SCHEMBL28430221 0.83 ALK (0.82) ALKMETFLT3EGFR
SCHEMBL28434053 0.83 ALK (1.00) ALKMETFLT3PTK2EGFR
SCHEMBL28430882 0.83 ALK (0.84) ALKMETFLT3PTK2EGFR

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 4 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 claimed
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 claimed
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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