SCHEMBL29317760

SCHEMBL29317760

CC(C)OC(C)(C)C(=O)N1CCC(=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.37
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL29317761 0.77 CA2 (0.38)
SCHEMBL29317762 0.77 SMN1; SMN2 (0.47) ALDH1A1MAPTL3MBTL1
SCHEMBL29317765 0.76 DPP4 (0.39) LIPEALDH1A1MEN1KMT2AMAPK1
SCHEMBL1135314 0.75 HDAC6 (0.45) LIPEALDH1A1LMNAMEN1KMT2A
SCHEMBL29317766 0.75 CHRM2 (0.38) ALDH1A1MEN1KMT2A
SCHEMBL19798139 0.72 LIPE (0.35) LIPEMEN1KMT2AHDAC6
SCHEMBL304030 0.71 LIPE (0.41) LIPE
SCHEMBL21880723 0.69 RIPK1 (0.49) LIPEKMT2A
SCHEMBL422791 0.67 ESR1 (0.45) LIPEKMT2AMAPK1
SCHEMBL640493 0.67 LIPE (0.44) LIPEALDH1A1LMNAMEN1KMT2A

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-2024145931-A1 SMALL MOLECULE INHIBITOR FOR β-CATENIN/BCL9 PROTEIN-PROTEIN INTERACTION AND USE THEREOF 上海医药工业研究院有限公司 2024-07-11 WO disclosed