SCHEMBL29868384

SCHEMBL29868384

CNC(=O)Nc1cnn2c(NC)cc(Nc3cccc(-c4cnn(C)c4)c3OC)nc12

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.48
▸ PDE4D Q08499 1/20 0.44
▸ STAT3 P40763 1/20 0.42
▸ JAK1 P23458 1/20 0.41

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
SCHEMBL23327195 1.00 TYK2 (0.48) TYK2PDE4DSTAT3JAK1
SCHEMBL23327407 0.85 TYK2 (0.48) TYK2PDE4DSTAT3JAK1
SCHEMBL30548443 0.85 TYK2 (0.48) TYK2PDE4DSTAT3JAK1
SCHEMBL23327397 0.84 TYK2 (0.46) TYK2PDE4DSTAT3JAK1
SCHEMBL23327701 0.80 TYK2 (0.56) TYK2PDE4DSTAT3JAK1
SCHEMBL30548451 0.80 TYK2 (0.56) TYK2PDE4DSTAT3JAK1
SCHEMBL23327694 0.80 TYK2 (0.47) TYK2PDE4D
SCHEMBL30548439 0.78 TYK2 (0.65) TYK2PDE4DJAK1
SCHEMBL23327427 0.78 TYK2 (0.65) TYK2PDE4DJAK1
SCHEMBL23327557 0.78 MAPT (0.45) TYK2PDE4DSTAT3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114929226-B TYK2 pseudokinase ligands 温缇克斯生物科学公司 2024-09-27 — — CN disclosed
EP-4054581-A1 TYK2 PSEUDOKINASE LIGANDS Ventyx Biosciences, Inc. (US) 2022-09-14 — — EP disclosed
CN-114929226-A TYK2 pseudokinase ligands 温缇克斯生物科学公司 2022-08-19 — — CN disclosed
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