SCHEMBL7360708

SCHEMBL7360708

N[C@@H](Cc1ccccc1F)C(=O)N(C(=O)OCc1ccccc1)c1n[nH]c(=S)s1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 11/20 0.38
MMP1 P03956 4/20 0.36
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PTPN1 P18031 1/20 0.34
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC15A1 P46059 1/20 0.33
MMP2 P08253 1/20 0.33
SLC1A5 Q15758 1/20 0.32

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
SCHEMBL7426285 0.90 MMP3 (0.44) MMP3MMP1MAPTALDH1A1HPGD
SCHEMBL7484700 0.88 MMP3 (0.37) MMP3MMP1MAPTALDH1A1HPGD
SCHEMBL7357685 0.79 MMP3 (0.44) MMP3MMP1MAPTALDH1A1HPGD
SCHEMBL7358708 0.78 MMP3 (0.42) MMP3MMP1MMP2
SCHEMBL7562073 0.78 MMP3 (0.44) MMP3MMP1MMP2
SCHEMBL7361335 0.77 MMP3 (0.42) MMP3MMP1MAPTALDH1A1HPGD
SCHEMBL7423322 0.77 ERAP2 (0.40) MMP3MMP1MMP2
SCHEMBL7358535 0.76 MMP3 (0.41) MMP3MMP1MAPTALDH1A1HPGD
SCHEMBL7357864 0.76 MMP3 (0.43) MMP3MMP1PTPN1MMP2
SCHEMBL7358850 0.76 MMP3 (0.38) MMP3MMP1MMP2

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
WO-1998025949-A1 SUBSTITUTED 5-AMINO-1,3,4-THIADIAZOLE-2-THIONES PROSCRIPT, INC. (US) 1998-06-18 WO disclosed
EP-0845002-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1998-06-03 EP disclosed
US-5677282-A ENZYME INHIBITOR; OSTEOARTHRITIS AND RHEUMATIC DISORDERS PROSCRIPT, INC. (US) 1997-10-14 US disclosed
WO-1996040745-A2 AMINO ACID AMIDES OF 5-AMINO-1,3,4-THIADIAZONES AND THEIR USE AS INHIBITORS FOR MATRIX METALLOPROTEINASES PROSCRIPT, INC. (US) 1996-12-19 WO disclosed