SCHEMBL31363483

SCHEMBL31363483

CC(C)(C)OC(=O)Nc1ccc(S(C)(=O)=O)cc1C(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK1 Q15118 1/20 0.43
▸ PDK2 Q15119 1/20 0.43
▸ PDK3 Q15120 1/20 0.43
▸ PDK4 Q16654 1/20 0.43
▸ GPR119 Q8TDV5 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ CYP17A1 P05093 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ KCNQ4 P56696 1/20 0.36
▸ KCNQ5 Q9NR82 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
SCHEMBL26376249 0.81 GPR119 (0.45) PDK1PDK2PDK3PDK4GPR119
SCHEMBL29811795 0.81 LMNA (0.48) PDK1PDK2PDK3PDK4GPR119
SCHEMBL23155477 0.81 LMNA (0.48) PDK1PDK2PDK3PDK4GPR119
SCHEMBL29430876 0.80 NPC1 (0.47) PDK1PDK2PDK3PDK4GPR119
SCHEMBL23155592 0.80 PDK1 (0.61) PDK1PDK2PDK3PDK4GPR119
SCHEMBL29812028 0.80 PDK1 (0.61) PDK1PDK2PDK3PDK4GPR119
SCHEMBL2002399 0.80 ALDH1A1 (0.60) PDK1PDK2PDK3PDK4ALDH1A1
SCHEMBL30177475 0.79 IRAK4 (0.48) PDK1PDK2PDK3PDK4GPR119
SCHEMBL24853597 0.79 IRAK4 (0.48) PDK1PDK2PDK3PDK4GPR119
SCHEMBL23155581 0.79 CNR2 (0.51) PDK1PDK2PDK3PDK4GPR119

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-2025059074-A1 BICYCLIC COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2025-03-20 — — WO disclosed
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