SCHEMBL29904276

SCHEMBL29904276

C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 14/20 0.41
▸ BACE2 Q9Y5Z0 2/20 0.41
▸ FNTA P49354 4/20 0.40
▸ FNTB P49356 4/20 0.40
▸ CTSD P07339 2/20 0.39

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
SCHEMBL29559148 0.93 FNTA (0.40) FNTAFNTB
SCHEMBL29476635 0.92 BMP1 (0.38) BACE1BACE2FNTAFNTB
SCHEMBL29370926 0.91 BACE1 (0.42) BACE1BACE2CTSD
SCHEMBL29757432 0.90 BACE1 (0.48) BACE1BACE2CTSD
SCHEMBL4216003 0.89 CALCR (0.39) BACE1BACE2FNTAFNTBCTSD
SCHEMBL30974452 0.89 BACE1 (0.39) BACE1BACE2CTSD
SCHEMBL30211127 0.88 FOLH1 (0.40) FNTAFNTB
SCHEMBL30632039 0.88 IL23R (0.40) BACE1
SCHEMBL31031462 0.87 BACE1 (0.42) BACE1BACE2CTSD
SCHEMBL31717951 0.87 C5AR1 (0.39) FNTAFNTB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4314017-A1 CONJUGATED HEPCIDIN MIMETICS Protagonist Therapeutics, Inc. (US) 2024-02-07 — — EP claimed
WO-2022212696-A1 CONJUGATED HEPCIDIN MIMETICS PROTAGONIST THERAPEUTICS, INC. (US) 2022-10-06 — — WO claimed
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