SCHEMBL8447157

SCHEMBL8447157

COC(=O)CCN(CC(C)C)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 8/20 0.50
ACE P12821 7/20 0.50
CTSB P07858 1/20 0.45
FDFT1 P37268 2/20 0.41
PTGES O14684 1/20 0.40
CASR P41180 1/20 0.38
CPA1 P15085 2/20 0.37
ACE2 Q9BYF1 2/20 0.37
LPAR1 Q92633 1/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36

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
SCHEMBL8450012 0.93 MME (0.49) MMEACECTSBFDFT1PTGES
SCHEMBL8446467 0.92 MME (0.53) MMEACECTSBFDFT1PTGES
SCHEMBL8452068 0.92 MME (0.48) MMEACECTSBFDFT1PTGES
SCHEMBL8451198 0.92 MME (0.48) MMEACECTSBFDFT1ACE2
SCHEMBL8446426 0.92 MME (0.48) MMEACECTSBFDFT1PTGES
SCHEMBL8451848 0.91 MME (0.46) MMEACECTSBFDFT1LPAR1
SCHEMBL8447319 0.89 MME (0.51) MMEACECTSBFDFT1PTGES
SCHEMBL8452849 0.88 ACE (0.45) MMEACECTSBFDFT1CPA1
SCHEMBL8451834 0.87 MME (0.44) MMEACECTSBFDFT1PTGES
SCHEMBL8450149 0.86 MME (0.43) MMEACECTSBFDFT1ACACB

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