SCHEMBL31376320

SCHEMBL31376320

NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.65
ERAP2 Q6P179 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47
LNPEP Q9UIQ6 1/20 0.47
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACE P12821 2/20 0.44
SPHK2 Q9NRA0 1/20 0.44
SPHK1 Q9NYA1 1/20 0.44
F2 P00734 1/20 0.43
KCNH2 Q12809 1/20 0.42
FAP Q12884 1/20 0.42
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42
DPP7 Q9UHL4 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL3223268 0.90 DPP4 (0.67) DPP4ALDH1A1SMN1; SMN2ACEF2
SCHEMBL3223258 0.90 DPP4 (0.67) DPP4ALDH1A1SMN1; SMN2ACEF2
SCHEMBL3238359 0.90 DPP4 (0.67) DPP4ALDH1A1SMN1; SMN2ACEF2
SCHEMBL3238628 0.90 DPP4 (0.67) DPP4ALDH1A1SMN1; SMN2ACEF2
SCHEMBL6980126 0.87 AGTR2 (0.52) DPP4
SCHEMBL8536863 0.86 DPP4 (0.49) DPP4ERAP2ERAP1LNPEPRAB9A
SCHEMBL13570514 0.86 F2 (0.53) DPP4ERAP2ERAP1LNPEPRAB9A
SCHEMBL5992939 0.84 DPP4 (0.60) DPP4ALDH1A1F2KCNH2
SCHEMBL13014739 0.83 DPP4 (0.58) DPP4F2KCNH2
SCHEMBL28797928 0.82 ERAP2 (0.48) DPP4ERAP2ERAP1LNPEPRAB9A

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-119451944-A PREP binding ligands 珀尔库治疗有限公司 2025-02-14 CN disclosed