SCHEMBL29397489

SCHEMBL29397489

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

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 19/20 0.62
▸ CTSD P07339 2/20 0.60
▸ BACE2 Q9Y5Z0 5/20 0.57

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
SCHEMBL29396146 0.96 BACE1 (0.62) BACE1CTSDBACE2
SCHEMBL29397483 0.93 BACE1 (0.68) BACE1CTSDBACE2
SCHEMBL29394515 0.93 BACE1 (0.68) BACE1CTSDBACE2
SCHEMBL29397926 0.93 BACE1 (0.67) BACE1CTSDBACE2
SCHEMBL30029172 0.92 BACE1 (0.59) BACE1CTSDBACE2
SCHEMBL32670624 0.91 BACE1 (0.61) BACE1
SCHEMBL30175896 0.91 BACE1 (0.68) BACE1CTSDBACE2
SCHEMBL31261771 0.90 TFPI (0.56) BACE1CTSDBACE2
SCHEMBL31257037 0.89 BACE1 (0.60) BACE1CTSDBACE2
SCHEMBL31672188 0.89 BACE1 (0.65) BACE1BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4196495-A1 EXENDIN-4 PEPTIDE ANALOGUES TXP Pharma GmbH (CH) 2023-06-21 — — EP claimed
WO-2022034062-A1 EXENDIN-4 PEPTIDE ANALOGUES TXP PHARMA AG (CH) 2022-02-17 — — WO claimed
EP-4196495-A1 EXENDIN-4 PEPTIDE ANALOGUES TXP Pharma GmbH (CH) 2023-06-21 — — EP disclosed
WO-2022034062-A1 EXENDIN-4 PEPTIDE ANALOGUES TXP PHARMA AG (CH) 2022-02-17 — — WO disclosed
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