SCHEMBL30778304

SCHEMBL30778304

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

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.62
▸ MME P08473 3/20 0.58
▸ BACE1 P56817 7/20 0.56
▸ BACE2 Q9Y5Z0 2/20 0.56
▸ CTSD P07339 1/20 0.54

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
SCHEMBL28786055 1.00 LTA4H (0.62) LTA4HMMEBACE1BACE2CTSD
SCHEMBL30368328 0.99 LTA4H (0.61) LTA4HMMEBACE1BACE2CTSD
SCHEMBL31556143 0.94 BACE1 (0.58) LTA4HMMEBACE1BACE2CTSD
SCHEMBL30051506 0.92 LTA4H (0.72) LTA4HMME
SCHEMBL29798170 0.92 LTA4H (0.61) LTA4HMMEBACE1
SCHEMBL30051692 0.91 LTA4H (0.67) LTA4HMME
SCHEMBL31004379 0.91 LTA4H (0.61) LTA4HMMEBACE1BACE2
SCHEMBL30833335 0.91 LTA4H (0.61) LTA4HMMEBACE1BACE2
SCHEMBL29436297 0.91 NPY4R (0.58) LTA4HBACE1BACE2
SCHEMBL30728874 0.90 LTA4H (0.59) LTA4HMMEBACE1BACE2CTSD

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-2024010219-A1 GROWTH PROMOTION COMPOSITION COMPRISING PEPTIDE DERIVED FROM WHEY PROTEIN (주)네오크레마 2024-01-11 — — WO disclosed
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