SCHEMBL31618960

SCHEMBL31618960

N[C@@H](Cc1c[nH]cn1)C(=O)N1CCCC[C@H]1C(=O)N1CC[C@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 3/20 0.38
▸ DPP4 P27487 3/20 0.38
▸ DPP8 Q6V1X1 1/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ ACE P12821 2/20 0.37
▸ OPRM1 P35372 2/20 0.36
▸ OPRD1 P41143 2/20 0.36
▸ DPP7 Q9UHL4 1/20 0.35

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
SCHEMBL7759104 0.95 DPP4 (0.42) LTA4HDPP4DPP8DPP9ACE
SCHEMBL7759091 0.95 DPP4 (0.42) LTA4HDPP4DPP8DPP9ACE
SCHEMBL4595209 0.91 DPP4 (0.44) LTA4HDPP4DPP8DPP9ACE
SCHEMBL4595206 0.91 DPP4 (0.44) LTA4HDPP4DPP8DPP9ACE
SCHEMBL5734357 0.91 DPP4 (0.44) LTA4HDPP4DPP8DPP9ACE
SCHEMBL10454953 0.87 TRHR (0.43) DPP4DPP8DPP9ACE
SCHEMBL10454951 0.87 TRHR (0.43) DPP4DPP8DPP9ACE
SCHEMBL29590456 0.87 TRHR (0.41) ACE
SCHEMBL29630526 0.87 TRHR (0.41) ACE
SCHEMBL678488 0.84 DPP4 (0.42) LTA4HDPP4DPP8DPP9ACE

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
CN-120136965-A Isolated polypeptide of targeted MPP8 protein and application thereof 苏州系统医学研究所 2025-06-13 — — CN disclosed
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