SCHEMBL29638394

SCHEMBL29638394

COc1cccc(-n2[nH]c(=O)c3cnc(Nc4cc(C)nc(C)n4)cc32)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 12/20 0.40
JAK1 P23458 2/20 0.39
TP53 P04637 1/20 0.35
LYN P07948 3/20 0.35
SRC P12931 3/20 0.35
BTK Q06187 3/20 0.35
ALOX5 P09917 1/20 0.34
ABL1 P00519 1/20 0.33
WEE1 P30291 2/20 0.33
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL27199231 1.00 TYK2 (0.40) TYK2JAK1TP53LYNSRC
SCHEMBL29638330 0.84 GAA (0.45) TYK2LYNSRCBTKABL1
SCHEMBL29638404 0.83 TYK2 (0.40) TYK2JAK1TP53
SCHEMBL24557274 0.83 BTK (0.46) TYK2JAK1LYNSRCBTK
SCHEMBL24557308 0.83 TYK2 (0.40) TYK2JAK1TP53
SCHEMBL24557292 0.83 TYK2 (0.36) TYK2JAK1LYNSRCBTK
SCHEMBL29638409 0.83 BTK (0.46) TYK2JAK1LYNSRCBTK
SCHEMBL29638445 0.83 TYK2 (0.36) TYK2JAK1LYNSRCBTK
SCHEMBL24557258 0.81 NPC1 (0.41) TYK2TP53LYNSRCBTK
SCHEMBL29638464 0.81 NPC1 (0.41) TYK2TP53LYNSRCBTK

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