SCHEMBL8616206

SCHEMBL8616206

CCC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)NCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 4/20 0.55
ANPEP P15144 3/20 0.55
CTSD P07339 2/20 0.55
F2 P00734 2/20 0.50
HTT P42858 1/20 0.50
ACE P12821 5/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
CTSL P07711 1/20 0.49
CTSB P07858 1/20 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
SCHEMBL8616218 1.00 LNPEP (0.55) LNPEPANPEPCTSDF2HTT
Hydrochloric Acid SCHEMBL8617113 0.91 MMP8 (0.52) CTSDACEMMP2MMP9MMP8
Hydrochloric Acid SCHEMBL8616769 0.91 HTT (0.61) LNPEPANPEPCTSDF2HTT
Hydrochloric Acid SCHEMBL8616778 0.91 HTT (0.61) LNPEPANPEPCTSDF2HTT
SCHEMBL8619183 0.90 LNPEP (0.58) LNPEPANPEPCTSDF2ACE
SCHEMBL8619169 0.90 LNPEP (0.58) LNPEPANPEPCTSDF2ACE
Hydrochloric Acid SCHEMBL8612979 0.89 MMP8 (0.57) ACEMMP2MMP9MMP8CTSL
Hydrochloric Acid SCHEMBL8619053 0.86 LNPEP (0.54) LNPEPANPEPCTSDACEMMP9
Hydrochloric Acid SCHEMBL8619036 0.86 LNPEP (0.54) LNPEPANPEPCTSDACEMMP9
SCHEMBL8618613 0.86 F2 (0.58) LNPEPANPEPF2

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