SCHEMBL22343305

SCHEMBL22343305

CCOc1ccc(-n2cccc(Nc3cc(NC)n4ncc(C(=O)N[C@@H]5C[C@@H]5F)c4n3)c2=O)nn1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.83

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
SCHEMBL20688296 1.00 TYK2 (0.83) TYK2
SCHEMBL22342912 0.93 TYK2 (0.75) TYK2
SCHEMBL20688297 0.91 TYK2 (1.00) TYK2
SCHEMBL22342875 0.90 TYK2 (0.94) TYK2
SCHEMBL29746827 0.90 TYK2 (0.94) TYK2
SCHEMBL20697524 0.87 TYK2 (0.75) TYK2
SCHEMBL20688268 0.86 TYK2 (1.00) TYK2
SCHEMBL20697086 0.86 TYK2 (0.81) TYK2
SCHEMBL22343316 0.85 TYK2 (0.90) TYK2
SCHEMBL20687804 0.85 TYK2 (0.90) TYK2

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
WO-2020163778-A1 TYK2 PSEUDOKINASE LIGANDS VENTYX BIOSCIENCES, INC. (US) 2020-08-13 — — WO disclosed
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