SCHEMBL29630636

SCHEMBL29630636

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

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.46
BACE1 P56817 18/20 0.46
CTSD P07339 4/20 0.45
DPP4 P27487 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
BACE2 Q9Y5Z0 2/20 0.41

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
SCHEMBL1674822 0.92 BACE1 (0.47) BMP1BACE1CTSDDPP4DPP8
SCHEMBL28605707 0.92 BACE1 (0.47) BMP1BACE1CTSDDPP4DPP8
SCHEMBL18797435 0.91 DPP4 (0.52) BMP1BACE1CTSDDPP4DPP8
SCHEMBL30421249 0.90 BACE1 (0.53) BACE1CTSDDPP4DPP8DPP9
SCHEMBL31410885 0.88 GLO1 (0.42) BMP1BACE1CTSD
SCHEMBL29590924 0.87 BACE1 (0.54) BACE1CTSDBACE2
SCHEMBL31181173 0.86 ENPEP (0.44) BACE1CTSDBACE2
SCHEMBL30578958 0.86 BACE1 (0.52) BACE1CTSDBACE2
SCHEMBL31344023 0.85 BACE1 (0.49) BACE1CTSDBACE2
SCHEMBL31720984 0.85 BACE1 (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 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