SCHEMBL29630764

SCHEMBL29630764

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

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 14/20 0.51
DPP4 P27487 1/20 0.47
DPP8 Q6V1X1 1/20 0.47
DPP9 Q86TI2 1/20 0.47
BACE1 P56817 5/20 0.46
CTSD P07339 2/20 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
SCHEMBL29892607 0.92 ENPEP (0.53) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL30685382 0.92 ENPEP (0.55) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL29893089 0.91 ENPEP (0.51) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL31410883 0.88 BACE1 (0.55) ENPEPBACE1CTSD
SCHEMBL29630477 0.88 ENPEP (0.60) ENPEPBACE1CTSD
SCHEMBL3708036 0.87 DPP4 (0.56) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL3708037 0.87 DPP4 (0.56) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL8529159 0.87 DPP4 (0.59) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL4388333 0.87 DPP4 (0.59) ENPEPDPP4DPP8DPP9BACE1
SCHEMBL29892622 0.86 ENPEP (0.58) ENPEPBACE1

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed