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SCHEMBL29934072

SCHEMBL29934072

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

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 3/20 0.53
▸ BACE1 P56817 16/20 0.49
▸ EGFR P00533 1/20 0.49
▸ BACE2 Q9Y5Z0 3/20 0.46
▸ CTSD P07339 4/20 0.46

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
SCHEMBL29876561 1.00 FOLH1 (0.53) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL29777777 0.98 FOLH1 (0.52) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31314410 0.96 FOLH1 (0.52) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31097692 0.96 FOLH1 (0.58) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31097663 0.96 FOLH1 (0.58) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31097709 0.96 FOLH1 (0.58) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31097730 0.96 FOLH1 (0.58) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31097742 0.96 FOLH1 (0.58) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31672189 0.95 FOLH1 (0.50) FOLH1BACE1EGFRBACE2CTSD
SCHEMBL31672191 0.95 FOLH1 (0.50) FOLH1BACE1EGFRBACE2CTSD

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-2022197266-A1 BETA-LACTOGLOBULIN AND BETA-LACTOGLOBULIN DERIVED PEPTIDE PRODUCTS FROM GOAT MILK MARMARA UNIVERSITESI REKTORLUGU OZEL KALEM BİRİMİ (TR) 2022-09-22 — — WO disclosed
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