SCHEMBL31536742

SCHEMBL31536742

CC(C)(C)OC(=O)N1CC(OS(C)(=O)=O)CO[C@H](COCc2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.41
KLK7 P49862 3/20 0.39
GPR119 Q8TDV5 3/20 0.39
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KLK5 Q9Y337 2/20 0.37
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
NAMPT P43490 1/20 0.36
USP30 Q70CQ3 1/20 0.36
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
PRMT5 O14744 2/20 0.36
PARP1 P09874 1/20 0.36
RORC P51449 1/20 0.36
TACR1 P25103 1/20 0.35
WDR77 Q9BQA1 1/20 0.35

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
SCHEMBL28989395 0.88 GAA (0.39) STSKLK7GPR119GAATHRB
SCHEMBL26782096 0.88 GAA (0.39) STSKLK7GPR119GAATHRB
SCHEMBL29579403 0.87 KLK7 (0.40) STSKLK7GPR119GAATHRB
SCHEMBL28712113 0.86 GAA (0.41) STSKLK7GPR119GAATHRB
SCHEMBL31536754 0.86 GAA (0.41) STSKLK7GPR119GAATHRB
SCHEMBL31536752 0.86 GAA (0.41) STSKLK7GPR119GAATHRB
SCHEMBL29579997 0.86 RORC (0.40) STSKLK7GAATHRBSMN1; SMN2
SCHEMBL29579552 0.86 GAA (0.38) STSKLK7GPR119GAATHRB
SCHEMBL28712137 0.85 GAA (0.39) STSKLK7GPR119GAATHRB
SCHEMBL28709747 0.85 USP30 (0.38) STSKLK7GPR119GAATHRB

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-2025059526-A1 DIPEPTIDYL PEPTIDASE 1 INHIBITORS AND USES THEREOF INSMED INCORPORATED (US) 2025-03-20 WO disclosed