SCHEMBL31548019

SCHEMBL31548019

CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 19/20 0.61
▸ CTSD P07339 2/20 0.57
▸ BACE2 Q9Y5Z0 2/20 0.56

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
SCHEMBL29371722 0.90 KISS1R (0.56) BACE1BACE2
SCHEMBL907360 0.88 FNTA (0.56) BACE1BACE2
SCHEMBL3646826 0.88 FNTA (0.56) BACE1BACE2
SCHEMBL907359 0.88 FNTA (0.56) BACE1BACE2
Acetic Acid SCHEMBL15201179 0.86 LTA4H (0.56) BACE1BACE2
Acetic Acid SCHEMBL15201182 0.86 LTA4H (0.56) BACE1BACE2
Formic Acid SCHEMBL27865482 0.84 FNTA (0.52) BACE1BACE2
SCHEMBL16430978 0.84 LTA4H (0.58) —
SCHEMBL16430977 0.84 LTA4H (0.58) —
SCHEMBL31614420 0.83 BACE1 (0.46) BACE1CTSD

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-2025097008-A2 MITOCHONDRIAL DNA INTRINSIC CONTROLS FOR USE IN MSRE-DEPENDENT DNA METHYLATION ANALYSIS NUCLEIX LTD. (IL) 2025-05-08 — — WO disclosed
Send feedback