SCHEMBL7444580

SCHEMBL7444580

O=C(O)CN1C(=O)[C@H](NC(=O)[C@H](S)Cc2ccccc2)CCc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 18/20 1.00
MME P08473 16/20 1.00

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
SCHEMBL7441045 1.00 ACE (1.00) ACEMME
SCHEMBL6440330 1.00 ACE (1.00) ACEMME
SCHEMBL29494164 1.00 ACE (1.00) ACEMME
SCHEMBL7444571 1.00 ACE (1.00) ACEMME
SCHEMBL6440328 1.00 ACE (1.00) ACEMME
SCHEMBL7343245 1.00 ACE (1.00) ACEMME
SCHEMBL7368989 1.00 ACE (1.00) ACEMME
SCHEMBL7343965 0.94 MME (1.00) ACEMME
SCHEMBL7343968 0.94 MME (1.00) ACEMME
SCHEMBL8837743 0.88 ACE (1.00) ACEMME

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
WO-1994026719-A1 MERCAPTO-AMIDE DERIVATIVES USEFUL AS NEUTRAL ENDOPEPTIDASE AND ACE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed