SCHEMBL6950356

SCHEMBL6950356

COC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)Nc1n[nH]c(=S)s1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 18/20 0.81
MMP1 P03956 11/20 0.81
MMP2 P08253 1/20 0.62
CA1 P00915 2/20 0.55
CA9 Q16790 2/20 0.55

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
SCHEMBL6961359 0.92 MMP3 (0.81) MMP3MMP1MMP2
SCHEMBL6948778 0.90 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL2680889 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL10118110 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6953778 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6957673 0.89 MMP3 (0.90) MMP3MMP1MMP2
SCHEMBL6952395 0.88 MMP3 (0.78) MMP3MMP1MMP2
SCHEMBL6951438 0.88 MMP3 (0.71) MMP3MMP1MMP2
SCHEMBL6956848 0.87 MMP3 (0.66) MMP3MMP1MMP2CA1CA9
SCHEMBL6956634 0.81 MMP3 (0.66) MMP3MMP1MMP2CA1CA9

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-0900211-B1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS UPJOHN CO (US) 2003-07-02 EP claimed
EP-0900211-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-03-10 EP claimed
WO-1997040031-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-10-30 WO claimed
EP-0900211-B1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS UPJOHN CO (US) 2003-07-02 EP disclosed
EP-0900211-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-03-10 EP disclosed
US-5847148-A Thiadiazole derivatives useful for the treatment of diseases related to connective tissue degradation PHARMACIA & UPJOHN COMPANY (US) 1998-12-08 US disclosed
WO-1997040031-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-10-30 WO disclosed