SCHEMBL7384535

SCHEMBL7384535

CC(C)CC(N)C(=O)N(C(=O)C(S)CCCN1C(=O)c2ccccc2C1=O)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.44
ANPEP P15144 1/20 0.42
RNPEP Q9H4A4 1/20 0.42
DNPEP Q9ULA0 1/20 0.42
MMP1 P03956 5/20 0.40
MMP3 P08254 4/20 0.40
MMP9 P14780 4/20 0.40
MMP2 P08253 2/20 0.40
MMP7 P09237 2/20 0.40
MMP14 P50281 2/20 0.40
MAOB P27338 4/20 0.38
ACE P12821 1/20 0.38
ACHE P22303 1/20 0.37
MME P08473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL8763029 0.83 ELANE (0.40) ELANEANPEPRNPEPDNPEPMMP1
SCHEMBL7763698 0.82 ELANE (0.40) ELANEANPEPRNPEPDNPEPMMP1
SCHEMBL7384926 0.80 ANPEP (0.44) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL7405706 0.80 ELANE (0.47) ELANEANPEPRNPEPDNPEPMMP1
SCHEMBL7382947 0.79 ANPEP (0.43) ANPEPRNPEPDNPEPMMP1ACE
SCHEMBL7887189 0.79 ELANE (0.40) ELANEMMP1MMP3MMP9MMP2
SCHEMBL7402091 0.79 ELANE (0.46) ELANEANPEPRNPEPDNPEPMMP1
SCHEMBL7403302 0.78 MMP1 (0.48) ELANEMMP1MMP3MMP9MMP2
SCHEMBL7402161 0.78 MMP3 (0.48) ELANEMMP1MMP3MMP9MMP2
SCHEMBL7397759 0.77 MMP3 (0.49) ELANEMMP1MMP3MMP9MMP2

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 4 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
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-1998026773-A1 USE OF MATRIX METALLOPROTEINASE INHIBITORS FOR TREATING NEUROLOGICAL DISORDERS AND PROMOTING WOUND HEALING WARNER-LAMBERT COMPANY (US) 1998-06-25 WO disclosed