SCHEMBL7360461

SCHEMBL7360461

C[C@H](NC(=O)c1cccnc1C(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.49
PREP P48147 8/20 0.48
FAP Q12884 6/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
LMNA P02545 1/20 0.46
DPP8 Q6V1X1 1/20 0.44
DPP9 Q86TI2 1/20 0.44
ACE2 Q9BYF1 2/20 0.43

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
SCHEMBL7367902 0.88 PREP (0.49) ACEPREPFAPALDH1A1LMNA
SCHEMBL11104635 0.85 ACE (0.55) ACEPREPFAPLMNAACE2
SCHEMBL7366700 0.84 ACE (0.50) ACEPREPFAPKDM4EALDH1A1
SCHEMBL7368109 0.79 PREP (0.43) ACEPREPFAPALDH1A1LMNA
SCHEMBL20355907 0.79 PREP (0.48) ACEPREPFAPLMNADPP8
SCHEMBL22209483 0.79 PREP (0.52) ACEPREPFAPALDH1A1LMNA
SCHEMBL11435575 0.79 ACE (0.71) ACEPREPFAPACE2
SCHEMBL29749309 0.79 ACE (0.71) ACEPREPFAPACE2
SCHEMBL3472327 0.79 ACE (0.71) ACEPREPFAPACE2
SCHEMBL10654820 0.78 ACE (0.49) ACEPREPFAPLMNAACE2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5432159-A N-(α-substituted-pyridinyl)carbonyl dipeptide antihypertensive agents LACER S.A. (ES) 1995-07-11 US disclosed
WO-1992015608-A1 N-(α-SUBSTITUTED-PYRIDINYL)CARBONYL DIPEPTIDE ANTIHYPERTENSIVE AGENTS LACER S.A. (ES) 1992-09-17 WO disclosed
EP-0500989-A1 N-(alpha-substituted-pyridinyl) carbonyl dipeptide antihypertensive agents LACER, S.A. (ES) 1992-09-02 EP disclosed