SCHEMBL5793022

SCHEMBL5793022

COc1ccc(CC2Sc3ccccc3N(CC(=O)ON)C2=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.48
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
GSK3B P49841 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
TSHR P16473 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.42
CYP3A4 P08684 2/20 0.42
CACNA1S Q13698 2/20 0.42
SLC22A1 O15245 1/20 0.42
CACNA1F O60840 1/20 0.42
ABCB11 O95342 1/20 0.42
ABCB1 P08183 1/20 0.42
HRH2 P25021 1/20 0.42
ADRA1A P35348 1/20 0.42
SCN1A P35498 1/20 0.42
SCN4A P35499 1/20 0.42

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
Hydroxyamine SCHEMBL5793019 0.88 MCL1 (0.51) PPARGLMNAHTTGSK3BSMN1; SMN2
SCHEMBL5796548 0.88 MCL1 (0.53) PPARGLMNAHTTGSK3BSMN1; SMN2
SCHEMBL5797144 0.88 GSK3B (0.47) PPARGLMNAHTTGSK3BSMN1; SMN2
SCHEMBL5798279 0.87 PPARG (0.46) PPARGLMNAHTTGSK3BSMN1; SMN2
SCHEMBL5746821 0.85 LMNA (0.53) LMNAHTTSMN1; SMN2TSHRL3MBTL1
SCHEMBL4972058 0.82 GSK3B (0.49) PPARGLMNAHTTGSK3BSMN1; SMN2
SCHEMBL5794208 0.81 PPARG (0.43) PPARGLMNAHTTGAA
SCHEMBL5747345 0.80 PPARG (0.54) PPARGLMNAHTTSMN1; SMN2CACNA1S
SCHEMBL6847052 0.80 PPARG (0.54) PPARGLMNAHTTSMN1; SMN2GAA
SCHEMBL5746099 0.79 GSK3B (0.46) PPARGLMNAHTTGSK3BSMN1; SMN2

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
EP-1173427-B1 HYDROXAMIC ACID DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2006-04-05 EP disclosed