SCHEMBL10653338

SCHEMBL10653338

C[C@H](NC(=O)c1cccs1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 10/20 0.48
▸ PREP P48147 1/20 0.46
▸ FAP Q12884 1/20 0.46
▸ ACE2 Q9BYF1 4/20 0.46
▸ POLB P06746 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TSHR P16473 1/20 0.44

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
SCHEMBL10654808 0.84 ACE (0.66) ACEPREPFAPACE2TSHR
SCHEMBL22811097 0.80 ALDH1A1 (0.49) ACEPREPFAPACE2LMNA
SCHEMBL10657887 0.79 ACE (0.56) ACEPREPFAPACE2LMNA
SCHEMBL3472327 0.79 ACE (0.71) ACEPREPFAPACE2TSHR
SCHEMBL11435575 0.79 ACE (0.71) ACEPREPFAPACE2TSHR
SCHEMBL29749309 0.79 ACE (0.71) ACEPREPFAPACE2TSHR
SCHEMBL10654820 0.78 ACE (0.49) ACEPREPFAPACE2LMNA
SCHEMBL10656412 0.78 ACE (0.58) ACEACE2LMNA
SCHEMBL10656626 0.78 ACE (0.52) ACEPREPFAPACE2LMNA
SCHEMBL10976266 0.77 ACE (0.78) ACEACE2

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
US-4719200-A Amino acid derivatives and antihypertensive drugs containing the same AJINOMOTO CO., INC. (JP) 1988-01-12 — — US disclosed
Send feedback