SCHEMBL24557263

SCHEMBL24557263

Cc1cc(Nc2cc3c(cn2)c(=O)[nH]n3-c2cccc(F)c2)nc(C)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 6/20 0.39
PLK1 P53350 1/20 0.38
BTK Q06187 3/20 0.36
PIK3C3 Q8NEB9 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
FYN P06241 1/20 0.35
ABCC1 P33527 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
HPGD P15428 1/20 0.34
SRC P12931 1/20 0.34
JAK1 P23458 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
RET P07949 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
SCHEMBL29638451 1.00 TYK2 (0.39) TYK2PLK1BTKPIK3C3TAAR1
SCHEMBL24557361 0.89 MAPT (0.45) TYK2PLK1FYNABCC1ABCG2
SCHEMBL29638328 0.89 TYK2 (0.36) TYK2BTKPIK3C3FYNABCC1
SCHEMBL29638464 0.89 NPC1 (0.41) TYK2BTKFYNALDH1A1MAPT
SCHEMBL24557258 0.89 NPC1 (0.41) TYK2BTKFYNALDH1A1MAPT
SCHEMBL29638398 0.87 CDK4 (0.40) TYK2FYNKDM4EMAPTGAA
SCHEMBL24557308 0.87 TYK2 (0.40) TYK2PLK1ABCC1ABCG2ALDH1A1
SCHEMBL29638404 0.87 TYK2 (0.40) TYK2PLK1ABCC1ABCG2ALDH1A1
SCHEMBL24557356 0.86 PHGDH (0.36) TYK2PLK1JAK1
SCHEMBL24557357 0.85 PLK1 (0.42) TYK2PLK1

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