SCHEMBL31474499

SCHEMBL31474499

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.61
DPP3 Q9NY33 5/20 0.59
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ITGB2 P05107 1/20 0.51
ICAM1 P05362 1/20 0.51
ITGAL P20701 1/20 0.51
NTSR2 O95665 1/20 0.51
NTSR1 P30989 1/20 0.51
SORT1 Q99523 1/20 0.51
OPRM1 P35372 1/20 0.51
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
MPO P05164 1/20 0.50
MAPT P10636 1/20 0.50
TSHR P16473 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
HIF1A Q16665 1/20 0.50
TACR1 P25103 2/20 0.49

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
SCHEMBL29842186 0.94 DPP3 (0.65) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30310949 0.92 DPP4 (0.59) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30052255 0.91 DPP3 (0.69) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL29963309 0.91 DPP3 (0.64) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30051283 0.90 DPP3 (0.61) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30050936 0.90 DPP3 (0.69) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30269204 0.89 DPP3 (0.57) DPP3NTSR2NTSR1SORT1OPRM1
SCHEMBL30866236 0.88 NTSR2 (0.60) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL29498733 0.88 DPP3 (0.63) DPP4DPP3MEN1KMT2AITGB2
SCHEMBL30051442 0.88 DPP4 (0.62) DPP4DPP3MEN1KMT2AITGB2

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-119827684-A Beijing white pear origin identification method based on metabonomics technology 北京市农林科学院 2025-04-15 CN disclosed