Sugi Predict

Sugi Predict / Compounds / SCHEMBL4592489

SCHEMBL4592489

SCHEMBL4592489

CC[C@H](C)[C@H](N)C(=O)OC(=O)[C@@H](N)[C@@H](C)OC(=O)[C@H](C)N

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 14/20 0.37
▸ DPP8 Q6V1X1 8/20 0.37
▸ DPP9 Q86TI2 7/20 0.37
▸ DPP7 Q9UHL4 7/20 0.33
▸ IARS1 P41252 3/20 0.32

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
SCHEMBL1537392 0.87 DPP4 (0.42) DPP4DPP8DPP9DPP7IARS1
SCHEMBL1537362 0.87 DPP4 (0.42) DPP4DPP8DPP9DPP7IARS1
SCHEMBL5161688 0.85 DPP4 (0.46) DPP4DPP8DPP9DPP7IARS1
SCHEMBL3930248 0.85 DPP4 (0.46) DPP4DPP8DPP9DPP7IARS1
SCHEMBL1965723 0.83 DPP4 (0.33) DPP4DPP8DPP9DPP7
SCHEMBL1446935 0.80 DPP4 (0.42) DPP4DPP8DPP9DPP7IARS1
SCHEMBL28044917 0.80 DPP4 (0.42) DPP4DPP8DPP9DPP7IARS1
SCHEMBL2143655 0.79 SLC7A5 (0.40) DPP4DPP8DPP9DPP7IARS1
SCHEMBL2052320 0.78 DPP4 (0.41) DPP4DPP8DPP9DPP7IARS1
Threonine SCHEMBL4592488 0.77 SLC7A5 (0.35) DPP4DPP8DPP9DPP7IARS1

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-1945043-A2 MICROORGANISM AND PROCESS FOR THE PREPARATION OF L-METHIONINE BASF SE (DE) 2008-07-23 — — EP disclosed
WO-2007051725-A2 MICROORGANISM AND PROCESS FOR THE PREPARATION OF L-METHIONINE BASF SE (DE) 2007-05-10 — — WO disclosed