SCHEMBL25460023

SCHEMBL25460023

CCC(C)C(NC(=O)C(NC(=O)C(N)CC(N)=O)C(C)C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ ENPEP Q07075 13/20 0.45
▸ CTSD P07339 4/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ BACE1 P56817 1/20 0.41

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
SCHEMBL31720964 0.94 ENPEP (0.44) ALDH1A1ENPEPCTSD
SCHEMBL29382432 0.94 ALDH1A1 (0.51) ALDH1A1ENPEPL3MBTL1
SCHEMBL31720879 0.90 ENPEP (0.48) ALDH1A1ENPEPCTSD
SCHEMBL30737597 0.90 BACE1 (0.44) ALDH1A1CTSDBACE1
SCHEMBL30390127 0.87 PDCD1LG2 (0.49) ALDH1A1ENPEP
SCHEMBL30051564 0.87 ALDH1A1 (0.47) ALDH1A1ENPEPCTSDL3MBTL1
SCHEMBL29426362 0.86 PDCD1LG2 (0.45) ALDH1A1CTSDBACE1
SCHEMBL29531923 0.86 PDCD1LG2 (0.45) ALDH1A1CTSDBACE1
SCHEMBL31696945 0.86 MME (0.49) ENPEPCTSDBACE1
SCHEMBL30390006 0.85 CD274 (0.52) CTSDBACE1

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-2023079142-A2 TARGETED LINEAR CONJUGATES COMPRISING POLYETHYLENEIMINE AND POLYETHYLENE GLYCOL AND POLYPLEXES COMPRISING THE SAME TARGIMMUNE THERAPEUTICS AG (CH) 2023-05-11 — — WO disclosed
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