SCHEMBL29794844

SCHEMBL29794844

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

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 18/20 0.57
▸ CTSD P07339 1/20 0.57
▸ BACE2 Q9Y5Z0 3/20 0.52

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
SCHEMBL30799561 0.95 BACE1 (0.54) BACE1CTSD
SCHEMBL29837354 0.92 BACE1 (0.61) BACE1CTSDBACE2
SCHEMBL31243883 0.91 BACE1 (0.56) BACE1CTSDBACE2
SCHEMBL31181197 0.91 BACE1 (0.54) BACE1CTSD
SCHEMBL31257028 0.91 BACE1 (0.60) BACE1CTSDBACE2
SCHEMBL30512585 0.91 BACE1 (0.60) BACE1CTSDBACE2
SCHEMBL29443821 0.90 BACE1 (0.65) BACE1CTSDBACE2
SCHEMBL10379929 0.90 GNPAT (0.54) BACE1CTSDBACE2
SCHEMBL10379927 0.90 GNPAT (0.54) BACE1CTSDBACE2
SCHEMBL29496483 0.89 MMP2 (0.54) BACE1CTSDBACE2

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
CN-114786706-A Glucagon, compositions comprising dual agonists of the GLP-1 receptor and the GIP receptor, and therapeutic uses thereof 韩美药品株式会社 2022-07-22 — — CN disclosed
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