SCHEMBL4965647

SCHEMBL4965647

C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)CCl

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.57
REN P00797 1/20 0.54
ACE P12821 2/20 0.53
CMA1 P23946 9/20 0.52
CTRB1 P17538 1/20 0.51
ELANE P08246 1/20 0.49
ACE2 Q9BYF1 1/20 0.48
CAPN1 P07384 1/20 0.47
XIAP P98170 2/20 0.47

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
SCHEMBL4956347 0.86 OPRM1 (0.52) CMA1XIAP
SCHEMBL11517511 0.85 PREP (0.70) PREPRENACECMA1CTRB1
SCHEMBL4726416 0.85 OPRM1 (0.55) XIAP
SCHEMBL9699165 0.83 CMA1 (0.65) PREPACECMA1
SCHEMBL9699161 0.83 CMA1 (0.65) PREPACECMA1
SCHEMBL11517201 0.83 PREP (0.68) PREPRENACECMA1CTRB1
SCHEMBL7319431 0.82 REN (0.65) PREPRENACECMA1CTRB1
SCHEMBL22209468 0.81 PREP (0.72) PREPACEELANEACE2
SCHEMBL7871516 0.81 PREP (0.72) PREPACEELANEACE2
SCHEMBL7334484 0.81 PREP (0.72) PREPACEELANEACE2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804558-B1 TRIPEPTIDYL AMINOPEPTIDASE NOVOZYMES AS (DK) 2008-01-23 EP disclosed
US-5821104-A DNA CONSTRUCT ENCODING THE ENZYME AND REDUCING PRODUCTION IN CELLS WHERE THE ACTICITY IS UNDESIRABLE NOVO NORDISK A/S (DK) 1998-10-13 US disclosed
EP-0804558-A2 TRIPEPTIDYL AMINOPEPTIDASE NOVO NORDISK A/S (DK) 1997-11-05 EP disclosed
WO-1996014404-A1 TRIPEPTIDYL AMINOPEPTIDASE NOVO NORDISK A/S (DK) 1996-05-17 WO disclosed
WO-1994025581-A1 MODIFIED RECOMBINANT TISSUE PLASMINOGEN ACTIVATOR SOUTHERN SYDNEY AREA HEALTH SERVICE (AU) 1994-11-10 WO disclosed