SCHEMBL6964276

SCHEMBL6964276

O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1n[nH]c(=S)s1)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 14/20 0.65
MMP1 P03956 10/20 0.65
MMP2 P08253 3/20 0.65
MMP9 P14780 2/20 0.57
MMP8 P22894 2/20 0.57
TACR1 P25103 2/20 0.54

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
SCHEMBL6964283 1.00 MMP3 (0.65) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7357677 0.92 MMP1 (0.68) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7357689 0.92 MMP1 (0.68) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7357861 0.92 MMP3 (0.62) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7357865 0.92 MMP3 (0.62) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7361337 0.91 MMP3 (0.64) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7361333 0.91 MMP3 (0.64) MMP3MMP1MMP2MMP9MMP8
SCHEMBL7358539 0.90 MMP3 (0.63) MMP3MMP1MMP2MMP9MMP8
SCHEMBL6968594 0.90 MMP3 (0.71) MMP3MMP1MMP2MMP9MMP8
SCHEMBL6962504 0.90 MMP3 (0.55) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021424-B1 THIADIAZOLE AMIDE MMP INHIBITORS UPJOHN CO (US) 2003-02-26 EP claimed
EP-1021424-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-26 EP claimed
WO-1997048688-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-12-24 WO claimed
EP-1021424-B1 THIADIAZOLE AMIDE MMP INHIBITORS UPJOHN CO (US) 2003-02-26 EP disclosed
EP-1021424-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-26 EP disclosed
WO-1998025949-A1 SUBSTITUTED 5-AMINO-1,3,4-THIADIAZOLE-2-THIONES PROSCRIPT, INC. (US) 1998-06-18 WO disclosed
WO-1997048688-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-12-24 WO disclosed