SCHEMBL6956147

SCHEMBL6956147

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 20/20 1.00
MMP1 P03956 13/20 0.80
MMP2 P08253 1/20 0.80

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
SCHEMBL10118131 1.00 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL2679911 1.00 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6953038 0.91 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6952195 0.89 MMP3 (0.81) MMP3MMP1MMP2
SCHEMBL6953380 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL2680889 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6953778 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL10118110 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6954588 0.89 MMP3 (1.00) MMP3MMP1MMP2
SCHEMBL6954614 0.88 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