SCHEMBL6960836

SCHEMBL6960836

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

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 20/20 0.57
MMP1 P03956 11/20 0.53
MMP2 P08253 3/20 0.51

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
SCHEMBL6953747 0.90 MMP3 (0.60) MMP3MMP1MMP2
SCHEMBL6953792 0.89 MMP3 (0.69) MMP3MMP1MMP2
SCHEMBL6953802 0.89 MMP3 (0.69) MMP3MMP1MMP2
SCHEMBL6962710 0.83 MMP3 (0.58) MMP3MMP1MMP2
SCHEMBL6950715 0.80 MMP3 (0.68) MMP3MMP1MMP2
SCHEMBL6950751 0.76 MMP3 (0.64) MMP3MMP1MMP2
SCHEMBL6954611 0.75 MMP3 (0.81) MMP3MMP1MMP2
SCHEMBL6950063 0.74 MMP3 (0.61) MMP3MMP1MMP2
SCHEMBL7332421 0.74 CA1 (0.41) MMP3MMP1MMP2
SCHEMBL2679911 0.73 MMP3 (1.00) 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 1 patent. 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