SCHEMBL24783783

SCHEMBL24783783

CCP(=O)(CC)c1cc(-c2cccc(Nc3cc(N)nnc3C=O)c2OC)nn1C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 20/20 0.33
▸ JAK1 P23458 2/20 0.33
▸ JAK2 O60674 1/20 0.31
▸ STAT3 P40763 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30

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
SCHEMBL24782692 0.80 JAK2 (0.48) TYK2JAK1JAK2STAT3KCNH2
SCHEMBL26983763 0.78 TLR8 (0.35) —
SCHEMBL30051006 0.78 TLR8 (0.35) —
SCHEMBL24783424 0.77 TYK2 (0.43) TYK2JAK1JAK2STAT3
SCHEMBL30780309 0.76 TYK2 (0.40) TYK2JAK2
SCHEMBL26983755 0.76 TYK2 (0.40) TYK2JAK2
SCHEMBL24782595 0.72 JAK2 (0.49) TYK2JAK1JAK2STAT3KCNH2
SCHEMBL30780306 0.72 TYK2 (0.56) TYK2JAK1JAK2STAT3
SCHEMBL26983730 0.72 TYK2 (0.56) TYK2JAK1JAK2STAT3
SCHEMBL26991434 0.72 TYK2 (0.43) TYK2JAK1JAK2STAT3

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-2022261524-A1 HETEROARYL COMPOUNDS AS INHIBITORS OF TYK2, COMPOSITION AND APPLICATION THEREOF ACCRO BIOSCIENCE (HK) LIMITED (CN) 2022-12-15 — — WO disclosed
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