SCHEMBL7433119

SCHEMBL7433119

O=C(O)CN1C(=O)C(NC(CCc2ccccc2)C(=O)O)CSC2C=CC=CC21

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.58

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
SCHEMBL7433352 0.90 ACE (0.53) ACE
SCHEMBL7423494 0.82 ACE (0.62) ACE
SCHEMBL7424221 0.82 ACE (0.62) ACE
SCHEMBL7423498 0.82 ACE (0.62) ACE
SCHEMBL10431400 0.80 ACE (0.64) ACE
SCHEMBL9525352 0.79 ACE (0.73) ACE
SCHEMBL9526161 0.79 ACE (0.62) ACE
SCHEMBL9525346 0.79 ACE (0.73) ACE
SCHEMBL9526737 0.79 ACE (0.73) ACE
SCHEMBL9525339 0.79 ACE (0.73) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4711884-A HYPOTENSIVE AGENTS; ANGIOTENSIN ENZYME INHIBITING ACTIVITY E. R. SQUIBB & SONS, INC. (US) 1987-12-08 US disclosed
EP-0120728-A1 Thiazine and thiazepine containing compounds E.R. Squibb & Sons, Inc. (US) 1984-10-03 EP disclosed