SCHEMBL29638438

SCHEMBL29638438

COCc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)nc(C)n4)cc32)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 16/20 0.36
JAK1 P23458 1/20 0.34
TP53 P04637 1/20 0.34
MIF P14174 1/20 0.33
MAPT P10636 1/20 0.32
PIK3CA P42336 1/20 0.32
PRKDC P78527 1/20 0.32

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
SCHEMBL29638352 0.89 ABCG2 (0.37) TYK2JAK1TP53
SCHEMBL29638528 0.87 TYK2 (0.33) TYK2JAK1TP53MAPT
SCHEMBL24557308 0.87 TYK2 (0.40) TYK2JAK1TP53MAPTPIK3CA
SCHEMBL29638404 0.87 TYK2 (0.40) TYK2JAK1TP53MAPTPIK3CA
SCHEMBL24557361 0.85 MAPT (0.45) TYK2MAPTPRKDC
SCHEMBL29638464 0.84 NPC1 (0.41) TYK2TP53MAPT
SCHEMBL24557258 0.84 NPC1 (0.41) TYK2TP53MAPT
SCHEMBL24557263 0.84 TYK2 (0.39) TYK2JAK1MAPT
SCHEMBL29638451 0.84 TYK2 (0.39) TYK2JAK1MAPT
SCHEMBL29638482 0.83 TYK2 (0.35) TYK2JAK1TP53MAPT

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