SCHEMBL23157239

SCHEMBL23157239

Cc1cccc(COC(=O)NCCCC[C@H](N)C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.55
DPP7 Q9UHL4 3/20 0.55
SLC1A3 P43003 1/20 0.54
SLC1A1 P43005 1/20 0.54
ANPEP P15144 1/20 0.53
DPP4 P27487 2/20 0.52
DPP9 Q86TI2 2/20 0.52
FOLH1 Q04609 6/20 0.49
SLC1A5 Q15758 1/20 0.48
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
CPB1 P15086 1/20 0.46
CPB2 Q96IY4 1/20 0.46
HSP90AA1 P07900 1/20 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
SCHEMBL15601802 0.97 SLC1A3 (0.55) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL18541541 0.87 DPP8 (0.56) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL453671 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL464672 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL5816135 0.87 DPP8 (0.69) DPP8DPP7SLC1A3SLC1A1ANPEP
Hydrochloric Acid SCHEMBL20945356 0.86 DPP8 (0.55) DPP8DPP7SLC1A3SLC1A1ANPEP
Hydrochloric Acid SCHEMBL20945357 0.86 DPP8 (0.55) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL18541548 0.86 TGM2 (0.58) DPP8DPP7SLC1A3SLC1A1ANPEP
SCHEMBL21219282 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP
Hydrochloric Acid SCHEMBL7297967 0.86 DPP8 (0.68) DPP8DPP7SLC1A3SLC1A1ANPEP

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
EP-2813512-B1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI PHARMACEUTICAL CO LTD (JP) 2021-03-31 EP disclosed