SCHEMBL29638481

SCHEMBL29638481

Cc1cc(Nc2cc3c(cn2)c(=O)[nH]n3-c2ccccc2S(C)(=O)=O)nc(C)n1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 17/20 0.49
PIK3C3 Q8NEB9 2/20 0.35
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
KCNH2 Q12809 1/20 0.34

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
SCHEMBL24557268 1.00 TYK2 (0.49) TYK2PIK3C3POLBGAAJAK2
SCHEMBL29638361 0.87 TYK2 (0.38) TYK2POLBGAAJAK1
SCHEMBL29638405 0.85 BTK (0.39) TYK2POLBGAA
SCHEMBL29638454 0.85 TYK2 (0.41) TYK2PIK3C3POLBGAA
SCHEMBL24557315 0.85 BTK (0.39) TYK2POLBGAA
SCHEMBL29638379 0.85 TYK2 (0.41) TYK2POLBGAAJAK2JAK1
SCHEMBL24557258 0.83 NPC1 (0.41) TYK2POLBGAA
SCHEMBL29638464 0.83 NPC1 (0.41) TYK2POLBGAA
SCHEMBL24557362 0.82 TYK2 (0.48) TYK2JAK2JAK1KCNH2
SCHEMBL29638386 0.82 TYK2 (0.48) TYK2JAK2JAK1KCNH2

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-2022136914-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2022-06-30 WO disclosed