SCHEMBL7264528

SCHEMBL7264528

CCCCCCN[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 14/20 0.62
ACE2 Q9BYF1 9/20 0.62
LTA4H P09960 3/20 0.54

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
SCHEMBL7319098 0.87 ACE (0.51) ACEACE2
SCHEMBL8652940 0.84 ACE (0.58) ACEACE2LTA4H
SCHEMBL8654621 0.84 ACE (0.58) ACEACE2LTA4H
SCHEMBL8652937 0.84 ACE (0.58) ACEACE2LTA4H
SCHEMBL8654625 0.84 ACE (0.58) ACEACE2LTA4H
SCHEMBL29634981 0.82 ACE (0.55) ACEACE2LTA4H
SCHEMBL6973372 0.82 LTA4H (0.63) ACEACE2LTA4H
SCHEMBL6979674 0.82 LTA4H (0.63) ACEACE2LTA4H
SCHEMBL6979678 0.82 LTA4H (0.63) ACEACE2LTA4H
SCHEMBL8656290 0.82 ACE (0.56) ACEACE2LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0185390-B1 TRIPEPTIDYL-ARGININALDEHYDE, PROCESS FOR ITS PREPARATION AND MEDICAMENTS THEREOF, AS WELL AS N-(MONOALKYL) AND N,N-DI-(ALKYL)-XXX-L-PROLINE DIPEPTIDE RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1991-10-02 EP disclosed
US-4703036-A ANTICOAGULANTS RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1987-10-27 US disclosed
EP-0185390-A2 Tripeptidyl-argininaldehyde, process for its preparation and medicaments thereof, as well as N-(monoalkyl) and N,N-di-(alkyl)-Xxx-L-proline dipeptide RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1986-06-25 EP disclosed