SCHEMBL22342915

SCHEMBL22342915

CNc1cc(Nc2c(F)c(F)cc3c2OCCO3)nc2c(C(=O)NC[C@@H](C)F)cnn12

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.49
▸ STAT3 P40763 1/20 0.42
▸ JAK1 P23458 1/20 0.42
▸ PDE4D Q08499 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
SCHEMBL22342920 0.87 TYK2 (0.49) TYK2STAT3
SCHEMBL22342916 0.86 TYK2 (0.58) TYK2
SCHEMBL22343317 0.84 TYK2 (0.69) TYK2
SCHEMBL22342919 0.78 TYK2 (0.51) TYK2
SCHEMBL22343427 0.76 TYK2 (0.52) TYK2JAK1PDE4D
SCHEMBL23327741 0.75 TYK2 (0.55) TYK2
SCHEMBL23351224 0.74 TYK2 (0.53) TYK2STAT3PDE4D
SCHEMBL22324243 0.73 TYK2 (0.67) TYK2JAK1PDE4D
SCHEMBL22342876 0.72 TYK2 (0.63) TYK2
SCHEMBL29746672 0.72 TYK2 (0.63) 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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