SCHEMBL7303271

SCHEMBL7303271

CC[C@H](C)[C@H](NC(=O)C(S)Cc1ccccc1)C(=O)N1CCCCC1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 9/20 0.61
▸ KMT2A Q03164 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ LTA4H P09960 5/20 0.52
▸ ACE2 Q9BYF1 4/20 0.49

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
SCHEMBL28256389 0.87 ACE (0.60) ACEKMT2AL3MBTL1LTA4HACE2
SCHEMBL30052918 0.87 ACE (0.60) ACEKMT2AL3MBTL1LTA4HACE2
SCHEMBL10766372 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL9069203 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL9068758 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL9090988 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL9069201 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL9068759 0.84 ACE (0.60) ACELTA4HACE2
SCHEMBL15251739 0.81 KMT2A (0.59) ACEKMT2AL3MBTL1LTA4HACE2
SCHEMBL15251740 0.81 KMT2A (0.59) ACEKMT2AL3MBTL1LTA4HACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0595878-A1 ACYLMERCAPTOALKANOYLDIPEPTIDES, METHODS OF PREPARATION AND THEIR THERAPEUTIC USE INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1994-05-11 — — EP claimed
WO-1993002099-A1 ACYLMERCAPTOALKANOYLDIPEPTIDES, METHODS OF PREPARATION AND THEIR THERAPEUTIC USE INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1993-02-04 — — WO claimed
EP-0524553-A1 Acylmercaptoalkanoyldipeptides, methods of preparation and their therapeutic use INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1993-01-27 — — EP claimed
US-5801274-A N- mercaptoacyl(amino acid or peptide)! compounds and S-lipophilic aliphatic carbonyl derivatives thereof as antihypertensives INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1998-09-01 — — US disclosed
US-5591891-A PEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-01-07 — — US disclosed
WO-1994017036-A1 S-LIPOPHILIC ALIPHATIC CARBONYL [N-MERCAPTOACYL-(AMINO ACID OR PEPTIDE)] COMPOUNDS AS ANTIHYPERTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1994-08-04 — — WO disclosed
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