SCHEMBL30992152

SCHEMBL30992152

CC(=O)CCCCC(=O)CCS(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 6/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HTT P42858 3/20 0.51
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51

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
SCHEMBL29275319 0.87 HSD11B1 (0.54) HSD11B1L3MBTL1KMT2AMAPTHDAC1
SCHEMBL9374645 0.87 HDAC1 (0.67) HSD11B1L3MBTL1KMT2AALDH1A1HTT
SCHEMBL1232793 0.86 HDAC1 (0.57) HSD11B1L3MBTL1KMT2AALDH1A1HTT
SCHEMBL6915414 0.86 ALDH1A1 (0.66) HSD11B1L3MBTL1KMT2AALDH1A1HTT
SCHEMBL27948820 0.81 HSD11B1 (0.59) HSD11B1L3MBTL1KMT2AHTTMAPT
SCHEMBL24590151 0.80 HSD11B1 (0.68) HSD11B1L3MBTL1KMT2AHTTMAPT
SCHEMBL5214593 0.77 MAPT (0.62) HSD11B1L3MBTL1KMT2AALDH1A1HTT
SCHEMBL5056819 0.75 KMT2A (0.57) KMT2AALDH1A1HTTMEN1LMNA
SCHEMBL5054683 0.75 KMT2A (0.57) KMT2AALDH1A1HTTMEN1LMNA
SCHEMBL5049885 0.75 KMT2A (0.57) KMT2AALDH1A1HTTMEN1LMNA

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-118373842-A Alpha/beta-functionalized alkylsilane-based peroxide, method for free radical conversion under Fe catalysis and application thereof 广东工业大学 2024-07-23 CN disclosed