SCHEMBL29129121

SCHEMBL29129121

CC(C)(C)OC(=O)N1CCN(C(=O)COc2cccc(OCCN)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.54
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
EPHX2 P34913 5/20 0.49
RECQL P46063 1/20 0.47
ALK Q9UM73 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
SIRT3 Q9NTG7 1/20 0.45
FKBP1A P62942 1/20 0.45
GPR119 Q8TDV5 1/20 0.45
HTR1A P08908 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL29613475 1.00 GAA (0.54) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL3216431 0.86 GAA (0.53) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL30257328 0.86 GAA (0.53) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL29613561 0.86 GAA (0.55) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL29129166 0.86 GAA (0.55) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL2616222 0.84 FKBP1A (0.65) GAAMEN1KMT2ARECQLALK
SCHEMBL29613462 0.83 GPR119 (0.55) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL29129076 0.83 GPR119 (0.55) GAAMEN1KMT2AEPHX2RECQL
SCHEMBL931999 0.83 MEN1 (0.72) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL15156208 0.82 GAA (0.51) GAAMEN1KMT2AEPHX2RECQL

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
CN-117279636-A Methods and compounds for modulating myotonic muscular dystrophy type 1 设计治疗公司 2023-12-22 CN disclosed