SCHEMBL8447142

SCHEMBL8447142

CC(C)CN(C[C@H](CCc1ccccc1)C(N)=O)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 9/20 0.47
ACE P12821 7/20 0.47
UTS2R Q9UKP6 2/20 0.40
ERAP2 Q6P179 5/20 0.37
ERAP1 Q9NZ08 5/20 0.37
LNPEP Q9UIQ6 3/20 0.37
IL1RN P18510 2/20 0.37
BCHE P06276 1/20 0.36
CTSB P07858 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL8446482 0.94 MME (0.49) MMEACEUTS2RBCHECTSB
SCHEMBL8451265 0.89 MME (0.49) MMEACEERAP2ERAP1LNPEP
SCHEMBL8449483 0.87 MME (0.42) MMEACEUTS2R
SCHEMBL8447133 0.85 MME (0.42) MMEACEUTS2RCTSBCYP3A4
SCHEMBL8453065 0.84 MME (0.51) MMEACECTSB
SCHEMBL8450113 0.83 MME (0.43) MMEACEUTS2RLNPEPCTSB
SCHEMBL8449905 0.83 MME (0.52) MMEACE
SCHEMBL8449504 0.82 MME (0.40) MMEACEUTS2R
SCHEMBL7573678 0.82 MME (0.71) MMEACEBCHE
SCHEMBL7573682 0.82 MME (0.71) MMEACEBCHE

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-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed