SCHEMBL7440402

SCHEMBL7440402

O=C(O)CN1C(=O)C(NC(=O)[C@H](S)Cc2ccccc2)CSc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 1.00
MME P08473 8/20 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
SCHEMBL7341603 1.00 ACE (1.00) ACEMME
SCHEMBL7440414 1.00 ACE (1.00) ACEMME
SCHEMBL7341608 1.00 ACE (1.00) ACEMME
SCHEMBL7349689 0.90 MME (1.00) ACEMME
SCHEMBL7349685 0.90 MME (1.00) ACEMME
SCHEMBL7342270 0.88 ACE (1.00) ACEMME
SCHEMBL7437956 0.88 ACE (1.00) ACEMME
SCHEMBL7447490 0.84 ACE (0.72) ACEMME
SCHEMBL7447485 0.84 ACE (0.72) ACEMME
SCHEMBL7442313 0.82 ACE (0.76) 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