SCHEMBL24263264

SCHEMBL24263264

CNc1cc(Nc2ccccc2S(C)(=O)=O)nn2c(C(N)=O)cnc12

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.64
▸ PDE4D Q08499 7/20 0.64
▸ JAK2 O60674 1/20 0.48
▸ JAK1 P23458 1/20 0.48
▸ JAK3 P52333 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
SCHEMBL24263406 0.82 TYK2 (0.69) TYK2PDE4DJAK2JAK1JAK3
SCHEMBL22421800 0.82 TYK2 (0.68) TYK2PDE4DJAK2JAK1JAK3
SCHEMBL22272929 0.81 TYK2 (0.62) TYK2PDE4D
SCHEMBL24263266 0.80 TYK2 (0.63) TYK2PDE4D
SCHEMBL24263261 0.79 TYK2 (0.57) TYK2PDE4D
SCHEMBL21571860 0.78 TYK2 (1.00) TYK2PDE4D
SCHEMBL21571871 0.77 TYK2 (1.00) TYK2PDE4D
SCHEMBL24263296 0.76 TYK2 (0.78) TYK2PDE4D
SCHEMBL29754460 0.76 TYK2 (0.78) TYK2PDE4D
SCHEMBL31218807 0.76 TYK2 (0.74) TYK2PDE4D

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-2022037694-A1 A CLASS OF FIVE- AND SIX-MEMBERED HETEROCYCLIC COMPOUNDS AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITORS 轶诺(浙江)药业有限公司 2022-02-24 — — WO disclosed
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