SCHEMBL7380347

SCHEMBL7380347

COC(=O)[C@@H]1CCCN1C(=O)CSC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 4/20 0.54
▸ KLK5 Q9Y337 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ ACE2 Q9BYF1 1/20 0.45
▸ ALOX5 P09917 1/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ FKBP1A P62942 1/20 0.45
▸ DPP4 P27487 1/20 0.44

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
SCHEMBL7380774 0.86 ACE (0.59) ACEALDH1A1ACE2KMT2A
SCHEMBL11154974 0.81 ACE (0.64) ACEKLK5ALDH1A1ACE2DPP4
SCHEMBL11448839 0.79 POLB (0.48) ACEKLK5ALDH1A1ALOX5FKBP1A
SCHEMBL1762519 0.79 KMT2A (0.59) ACEALDH1A1ALOX5KMT2A
SCHEMBL9871506 0.79 KMT2A (0.59) ACEALDH1A1ALOX5KMT2A
SCHEMBL24435015 0.79 KMT2A (0.59) ACEALDH1A1ALOX5KMT2A
SCHEMBL10509005 0.79 ACE (0.59) ACEKLK5ALDH1A1ALOX5FKBP1A
SCHEMBL6639156 0.79 ACE (0.59) ACEKLK5ALDH1A1ALOX5FKBP1A
SCHEMBL10508467 0.77 ACE (0.62) ACEKLK5ALDH1A1FKBP1A
SCHEMBL10508472 0.77 ACE (0.62) ACEKLK5ALDH1A1FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4833152-A Anti-hypertensive agents UNIVERSITY OF MIAMI (US) 1989-05-23 — — US disclosed
US-4745124-A THIO/ESTER PEPTIDES UNIVERSITY OF MIAMI (US) 1988-05-17 — — US disclosed
US-4734420-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME UNIVERSITY OF MIAMI (US) 1988-03-29 — — US disclosed
US-4692458-A Anti-hypertensive agents UNIVERSITY OF MIAMI (US) 1987-09-08 — — US disclosed
US-4690936-A AMINO ACIDS, THIOESTER LINKAGE; ANGIOTENSIN INHIBITORS UNIVERSITY OF MIAMI (US) 1987-09-01 — — US disclosed
EP-0036713-B1 ANGIOTENSIN CONVERTING ENZYME INHIBITORS UNIVERSITY OF MIAMI (US) 1984-01-18 — — EP disclosed
EP-0036713-A2 Angiotensin converting enzyme inhibitors UNIVERSITY OF MIAMI (US) 1981-09-30 — — EP disclosed
US-4154840-A Antihypertensive pipecolic acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-05-15 — — US disclosed
US-4105776-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS, HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1978-08-08 — — US disclosed
US-4046889-A HYPOTENSIVE AGENTS, ENZYME INHIBITORS, ANGIOTENSIN CONVERSION E. R. SQUIBB & SONS, INC. (US) 1977-09-06 — — US disclosed
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