SCHEMBL30992146

SCHEMBL30992146

CC(=O)CCCCC(=O)NCc1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.80
KMT2A Q03164 2/20 0.80
GAA P10253 1/20 0.77
EPHX2 P34913 5/20 0.73
FAAH O00519 3/20 0.62
TRPV1 Q8NER1 1/20 0.60
KEAP1 Q14145 1/20 0.60
NFE2L2 Q16236 1/20 0.60
CNR1 P21554 2/20 0.59
CNR2 P34972 2/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C19 P33261 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
LMNA P02545 1/20 0.59
ALDH1A1 P00352 2/20 0.58
HTT P42858 1/20 0.58
MAPT P10636 1/20 0.58

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
SCHEMBL19476509 0.97 GAA (0.83) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL2942358 0.91 MEN1 (0.96) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL6307396 0.89 GAA (0.70) MEN1KMT2AGAAEPHX2TRPV1
SCHEMBL1516109 0.86 EPHX2 (0.97) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL27909131 0.86 MEN1 (0.86) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL2524088 0.85 EPHX2 (1.00) MEN1KMT2AGAAEPHX2FAAH
Nonanoic Acid Benzylamide SCHEMBL3280214 0.85 EPHX2 (1.00) MEN1KMT2AGAAEPHX2FAAH
N-Benzyldodecanamide SCHEMBL3977374 0.85 EPHX2 (1.00) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL5696750 0.85 EPHX2 (1.00) MEN1KMT2AGAAEPHX2FAAH
SCHEMBL16714726 0.85 EPHX2 (1.00) MEN1KMT2AGAAEPHX2FAAH

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