SCHEMBL8615323

SCHEMBL8615323

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)NCc1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 9/20 0.51
ANPEP P15144 8/20 0.51
ACE P12821 6/20 0.47
MME P08473 1/20 0.47
CPA1 P15085 1/20 0.47
ACE2 Q9BYF1 1/20 0.47
CTSD P07339 1/20 0.46
OPRD1 P41143 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
AGTR1 P30556 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
SCHEMBL8615303 1.00 LNPEP (0.51) LNPEPANPEPACEMMECPA1
SCHEMBL8619183 0.93 LNPEP (0.58) LNPEPANPEPACEMMECPA1
SCHEMBL8619169 0.93 LNPEP (0.58) LNPEPANPEPACEMMECPA1
SCHEMBL8616692 0.91 LNPEP (0.49) LNPEPANPEPACEMMECPA1
SCHEMBL8616672 0.91 LNPEP (0.49) LNPEPANPEPACEMMECPA1
Hydrochloric Acid SCHEMBL8619036 0.91 LNPEP (0.54) LNPEPANPEPACEMMECPA1
Hydrochloric Acid SCHEMBL8619053 0.91 LNPEP (0.54) LNPEPANPEPACEMMECPA1
Hydrochloric Acid SCHEMBL8614607 0.87 ANPEP (0.52) LNPEPANPEPACEMMECPA1
Hydrochloric Acid SCHEMBL8614620 0.87 ANPEP (0.52) LNPEPANPEPACEMMECPA1
Hydrochloric Acid SCHEMBL8613597 0.87 CTSD (0.56) LNPEPANPEPACEMMECPA1

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
EP-0838471-A1 PEPTIDE DERIVATIVES AND ANGIOTENSIN IV RECEPTOR AGONIST SAGAMI CHEMICAL RESEARCH CENTER (JP) 1998-04-29 EP disclosed