SCHEMBL29638462

SCHEMBL29638462

COc1c(-n2[nH]c(=O)c3cnc(Nc4ccc(F)cn4)cc32)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 6/20 0.41
JAK1 P23458 5/20 0.41
BTK Q06187 11/20 0.40
SRC P12931 8/20 0.40
LYN P07948 6/20 0.38
JAK2 O60674 2/20 0.36
PDE4D Q08499 2/20 0.36
PIK3CA P42336 1/20 0.36

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
SCHEMBL29638389 0.89 BTK (0.48) TYK2JAK1BTKSRCLYN
SCHEMBL29638420 0.87 BTK (0.47) TYK2JAK1BTKSRCLYN
SCHEMBL29638317 0.85 TYK2 (0.42) TYK2JAK1JAK2PIK3CA
SCHEMBL24557265 0.84 JAK1 (0.43) TYK2JAK1BTKSRCLYN
SCHEMBL29638331 0.84 JAK1 (0.43) TYK2JAK1BTKSRCLYN
SCHEMBL24557309 0.84 JAK1 (0.46) TYK2JAK1BTKSRCLYN
SCHEMBL29638410 0.84 JAK1 (0.46) TYK2JAK1BTKSRCLYN
SCHEMBL29638493 0.80 BTK (0.44) TYK2JAK1BTKSRCLYN
SCHEMBL24557321 0.79 BTK (0.48) TYK2JAK1BTKSRCLYN
SCHEMBL29638407 0.79 BTK (0.48) TYK2JAK1BTKSRCLYN

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