SCHEMBL7363545

SCHEMBL7363545

C[C@H](NC(=O)c1ccc(C(=O)O)nc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.51
PREP P48147 5/20 0.49
FAP Q12884 5/20 0.49
DPP8 Q6V1X1 1/20 0.47
DPP9 Q86TI2 1/20 0.47
ACE2 Q9BYF1 4/20 0.46
P4HTM Q9NXG6 2/20 0.45

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
SCHEMBL7367822 0.87 PREP (0.52) ACEPREPFAPDPP8DPP9
SCHEMBL11435575 0.82 ACE (0.71) ACEPREPFAPACE2
SCHEMBL29749309 0.82 ACE (0.71) ACEPREPFAPACE2
SCHEMBL3472327 0.82 ACE (0.71) ACEPREPFAPACE2
SCHEMBL17345171 0.81 PREP (0.70) ACEPREPFAPDPP8DPP9
SCHEMBL18619575 0.81 ACE (0.58) ACEPREPFAPDPP8DPP9
SCHEMBL22811164 0.81 ACE (0.58) ACEPREPFAPDPP8DPP9
SCHEMBL22811209 0.81 ACE (0.58) ACEPREPFAPDPP8DPP9
SCHEMBL7361318 0.81 ACE (0.50) ACEPREPFAPDPP8DPP9
SCHEMBL10654808 0.80 ACE (0.66) ACEPREPFAPACE2

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