SCHEMBL7382947

SCHEMBL7382947

COC(=O)CCCCC(S)C(=O)N(C(=O)C(N)CC(C)C)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.43
RNPEP Q9H4A4 1/20 0.43
DNPEP Q9ULA0 1/20 0.43
MMP1 P03956 2/20 0.43
ACE P12821 5/20 0.41
MME P08473 1/20 0.40
REN P00797 1/20 0.40
LTA4H P09960 1/20 0.39
LAP3 P28838 1/20 0.37

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
SCHEMBL7384926 0.97 ANPEP (0.44) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL8764855 0.85 MMP1 (0.48) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL8763008 0.81 ANPEP (0.42) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL8764118 0.81 LTA4H (0.38) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL7384535 0.79 ELANE (0.44) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL7427977 0.79 REN (0.40) ANPEPRNPEPDNPEPMMP1REN
SCHEMBL7999637 0.78 ANPEP (0.51) ANPEPRNPEPDNPEPACEREN
SCHEMBL6414041 0.77 MME (0.48) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL27468737 0.77 ANPEP (0.53) ANPEPRNPEPDNPEPACEMME
SCHEMBL7427886 0.76 MMP1 (0.47) MMP1ACEMMEREN

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-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP disclosed
EP-1047450-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 2000-11-02 EP disclosed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO disclosed
EP-0946166-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1999-10-06 EP disclosed
WO-1999032150-A1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO disclosed
WO-1998026773-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1998-06-25 WO disclosed