SCHEMBL29638449

SCHEMBL29638449

Cc1cc(Nc2cc3c(cn2)c(=O)[nH]n3-c2cccc(F)c2F)nc(C)n1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 9/20 0.42
BTK Q06187 5/20 0.35
SRC P12931 5/20 0.35
LYN P07948 2/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
JAK1 P23458 1/20 0.33
PLK1 P53350 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 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
SCHEMBL24557255 1.00 TYK2 (0.42) TYK2BTKSRCLYNPIK3C3
SCHEMBL29638454 0.92 TYK2 (0.41) TYK2BTKSRCLYNPIK3C3
SCHEMBL29638372 0.89 TYK2 (0.42) TYK2BTKSRCJAK1PLK1
SCHEMBL29638436 0.89 TYK2 (0.51) TYK2JAK1
SCHEMBL24557300 0.89 TYK2 (0.51) TYK2JAK1
SCHEMBL29638361 0.86 TYK2 (0.38) TYK2BTKSRCLYNJAK1
SCHEMBL24557315 0.84 BTK (0.39) TYK2BTKSRCLYNPOLB
SCHEMBL29638405 0.84 BTK (0.39) TYK2BTKSRCLYNPOLB
SCHEMBL29638379 0.84 TYK2 (0.41) TYK2BTKSRCLYNJAK1
SCHEMBL24557263 0.83 TYK2 (0.39) TYK2BTKSRCPIK3C3JAK1

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