SCHEMBL25075481

SCHEMBL25075481

CCN(CCCCOC)CCCOC

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
KDM4E B2RXH2 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 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
SCHEMBL25075401 0.97 ALDH1A1 (0.44) ALDH1A1BCHEACHEMAOAMAOB
SCHEMBL11145596 0.92 ALDH1A1 (0.48) ALDH1A1BCHEACHEMAOAMAOB
SCHEMBL20929800 0.91 ALDH1A1 (0.41) ALDH1A1BCHEACHEMAOAMAOB
SCHEMBL21540252 0.90 MEN1 (0.35) ALDH1A1KDM4EMAOAMAOB
SCHEMBL1018851 0.90 ALDH1A1 (0.41) ALDH1A1KDM4EMAOB
SCHEMBL29520677 0.89 KCNH2 (0.46) ALDH1A1
SCHEMBL13003162 0.88 ALDH1A1 (0.34) ALDH1A1KDM4E
Water SCHEMBL15361516 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EMAOB
Fluoride SCHEMBL15361776 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EMAOB
Bromide SCHEMBL15361748 0.87 ALDH1A1 (0.40) ALDH1A1KDM4EMAOB

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-2023022926-A1 NANOPARTICLE COMPOSITIONS CONTAINING SUGAR FUNCTIONALIZED NUCLEIC ACID CARRIERS TIBA BIOTECH LLC (US) 2023-02-23 WO disclosed