SCHEMBL22342931

SCHEMBL22342931

CNc1cc(Nc2c(F)c(F)cc(F)c2F)nc2c(C=O)cnn12

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CSNK2B P67870 1/20 0.46
▸ TYK2 P29597 19/20 0.41
▸ PDE4D Q08499 2/20 0.37

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
SCHEMBL22342885 0.75 TYK2 (0.71) TYK2PDE4D
SCHEMBL22343427 0.75 TYK2 (0.52) TYK2PDE4D
SCHEMBL22324243 0.72 TYK2 (0.67) TYK2PDE4D
SCHEMBL23327511 0.72 TYK2 (0.51) TYK2
SCHEMBL14158142 0.70 CSNK2B (0.57) CSNK2BTYK2PDE4D
SCHEMBL2032405 0.68 CSNK2B (0.68) CSNK2BTYK2PDE4D
SCHEMBL1487862 0.67 CSNK2B (0.62) CSNK2BTYK2
SCHEMBL14158073 0.67 CSNK2B (0.40) CSNK2BTYK2
SCHEMBL12841015 0.66 CSNK2B (0.61) CSNK2BTYK2
SCHEMBL12583268 0.66 CSNK2B (0.61) CSNK2B

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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