SCHEMBL30992132

SCHEMBL30992132

CC(C)C(=O)CC[C@@H](C)CC(=O)CC1(C)C(=O)N(C)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.44
ALDH1A1 P00352 7/20 0.40
MAPT P10636 5/20 0.40
PKM P14618 1/20 0.40
TSHR P16473 3/20 0.38
LMNA P02545 3/20 0.38
GAA P10253 3/20 0.36
MAPK1 P28482 3/20 0.36
CBX7 O95931 2/20 0.36
CDY1; CDY1B Q9Y6F8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CDYL2 Q8N8U2 1/20 0.36
CDYL Q9Y232 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL30992133 0.83 RAD52 (0.51) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992147 0.77 ALDH1A1 (0.50) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992144 0.74 ALDH1A1 (0.46) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992140 0.74 ALDH1A1 (0.51) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992148 0.74 ALDH1A1 (0.51) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL28850422 0.74 ALDH1A1 (0.52) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL28850424 0.74 ALDH1A1 (0.52) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992126 0.74 RAD52 (0.47) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992155 0.73 ALDH1A1 (0.50) RAD52ALDH1A1MAPTPKMTSHR
SCHEMBL30992157 0.72 RAD52 (0.56) RAD52ALDH1A1MAPTPKMTSHR

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