SCHEMBL6963121

SCHEMBL6963121

CC(C)C[C@@H](CC(=O)Nc1n[nH]c(=S)s1)NC(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 16/20 0.52
MMP1 P03956 5/20 0.52
MMP2 P08253 1/20 0.48
CTSK P43235 2/20 0.44

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
SCHEMBL6969997 1.00 MMP3 (0.52) MMP3MMP1MMP2CTSK
SCHEMBL6961636 0.85 CTSK (0.59) MMP3MMP1MMP2CTSK
SCHEMBL6961631 0.85 CTSK (0.59) MMP3MMP1MMP2CTSK
SCHEMBL6962615 0.84 MMP3 (0.53) MMP3MMP1MMP2
SCHEMBL6967414 0.83 MMP3 (0.52) MMP3MMP1MMP2
SCHEMBL6964530 0.83 MMP3 (0.52) MMP3MMP1MMP2
SCHEMBL6964527 0.83 MMP3 (0.52) MMP3MMP1MMP2
SCHEMBL6967976 0.81 MMP1 (0.55) MMP3MMP1MMP2
SCHEMBL6967981 0.81 MMP1 (0.55) MMP3MMP1MMP2
SCHEMBL6968692 0.81 MMP3 (0.56) 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 3 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 disclosed
EP-1021424-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-26 EP disclosed
WO-1997048688-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-12-24 WO disclosed